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At least 397 records · Page 22

Materials Data on Pb2O by Materials Project

Pb2O is Cuprite structured and crystallizes in the cubic Pn-3m space group. The structure is three-dimensional. Pb is bonded in a linear geometry to two equivalent O atoms. Both Pb–O bond lengths are 2.37 Å. O is bonded to four equivalent Pb atoms to form corner-sharing OPb4 tetrahedra.

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Materials Data on PH9AuC3ClO3 by Materials Project

AuC3PH9O3Cl crystallizes in the orthorhombic Pbca space group. The structure is zero-dimensional and consists of eight akos030621936 molecules. Au1- is bonded in a linear geometry to one P5+ and one Cl1- atom. The Au–P bond length is 2.24 Å. The Au–Cl bond length is 2.34 Å. There are three inequivalent C2- sites. In the first C2- site, C2- is bonded to three H1+ and one O2- atom to form CH3O tetrahedra that share a cornercorner with one PAuO3 tetrahedra. All C–H bond lengths are 1.10 Å. The C–O bond length is 1.46 Å. In the second C2- site, C2- is bonded to three H1+ and one O2- atom to form CH3O tetrahedra that share a cornercorner with one PAuO3 tetrahedra. All C–H bond lengths are 1.10 Å. The C–O bond length is 1.46 Å. In the third C2- site, C2- is bonded to three H1+ and one O2- atom to form CH3O tetrahedra that share a cornercorner with one PAuO3 tetrahedra. There is one shorter (1.09 Å) and two longer (1.10 Å) C–H bond length. The C–O bond length is 1.46 Å. P5+ is bonded to one Au1- and three O2- atoms to form distorted PAuO3 tetrahedra that share corners with three CH3O tetrahedra. There is two shorter (1.60 Å) and one longer (1.61 Å) P–O bond length. There are nine inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the fifth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the sixth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the seventh H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the eighth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the ninth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 120 degrees geometry to one C2- and one P5+ atom. In the second O2- site, O2- is bonded in a bent 120 degrees geometry to one C2- and one P5+ atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one C2- and one P5+ atom. Cl1- is bonded in a single-bond geometry to one Au1- atom.

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Materials Data on PH9AuC3S3Cl by Materials Project

AuC3PH9S3Cl crystallizes in the orthorhombic Pbca space group. The structure is zero-dimensional and consists of eight AuC3PH9S3Cl clusters. Au1- is bonded in a linear geometry to one P5+ and one Cl1- atom. The Au–P bond length is 2.27 Å. The Au–Cl bond length is 2.34 Å. There are three inequivalent C2- sites. In the first C2- site, C2- is bonded in a trigonal non-coplanar geometry to three H1+ and one S2- atom. There is one shorter (1.09 Å) and two longer (1.10 Å) C–H bond length. The C–S bond length is 1.82 Å. In the second C2- site, C2- is bonded in a trigonal non-coplanar geometry to three H1+ and one S2- atom. There is one shorter (1.09 Å) and two longer (1.10 Å) C–H bond length. The C–S bond length is 1.82 Å. In the third C2- site, C2- is bonded in a trigonal non-coplanar geometry to three H1+ and one S2- atom. There is one shorter (1.09 Å) and two longer (1.10 Å) C–H bond length. The C–S bond length is 1.82 Å. P5+ is bonded in a tetrahedral geometry to one Au1- and three S2- atoms. There are two shorter (2.10 Å) and one longer (2.11 Å) P–S bond lengths. There are nine inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the fifth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the sixth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the seventh H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the eighth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the ninth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded in a water-like geometry to one C2- and one P5+ atom. In the second S2- site, S2- is bonded in a water-like geometry to one C2- and one P5+ atom. In the third S2- site, S2- is bonded in a water-like geometry to one C2- and one P5+ atom. Cl1- is bonded in a single-bond geometry to one Au1- atom.

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Materials Data on SbCNCl6 by Materials Project

CSbNCl6 crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four CSbNCl6 clusters. C4+ is bonded in a linear geometry to one N3- and one Cl1- atom. The C–N bond length is 1.17 Å. The C–Cl bond length is 1.59 Å. Sb5+ is bonded in an octahedral geometry to one N3- and five Cl1- atoms. The Sb–N bond length is 2.32 Å. There are one shorter (2.37 Å) and four longer (2.38 Å) Sb–Cl bond lengths. N3- is bonded in a distorted linear geometry to one C4+ and one Sb5+ atom. There are four inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a single-bond geometry to one Sb5+ atom. In the second Cl1- site, Cl1- is bonded in a single-bond geometry to one Sb5+ atom. In the third Cl1- site, Cl1- is bonded in a single-bond geometry to one Sb5+ atom. In the fourth Cl1- site, Cl1- is bonded in a single-bond geometry to one C4+ atom.

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Materials Data on H2CN2 by Materials Project

CN2H2 crystallizes in the orthorhombic Pbca space group. The structure is zero-dimensional and consists of eight cyanamide molecules. C4+ is bonded in a linear geometry to two N3- atoms. There is one shorter (1.18 Å) and one longer (1.31 Å) C–N bond length. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded in a single-bond geometry to one C4+ atom. In the second N3- site, N3- is bonded in a trigonal planar geometry to one C4+ and two H1+ atoms. Both N–H bond lengths are 1.03 Å. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom.

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Materials Data on LiCr10O15 by Materials Project

LiCr10O15 is Ilmenite-like structured and crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. Li1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Li–O bond lengths are 2.60 Å. There are three inequivalent Cr+2.90+ sites. In the first Cr+2.90+ site, Cr+2.90+ is bonded to six O2- atoms to form a mixture of distorted edge and corner-sharing CrO6 octahedra. The corner-sharing octahedra tilt angles range from 0–58°. There are a spread of Cr–O bond distances ranging from 2.02–2.32 Å. In the second Cr+2.90+ site, Cr+2.90+ is bonded to six O2- atoms to form a mixture of edge, face, and corner-sharing CrO6 octahedra. The corner-sharing octahedra tilt angles range from 11–51°. There are a spread of Cr–O bond distances ranging from 1.98–2.07 Å. In the third Cr+2.90+ site, Cr+2.90+ is bonded to six O2- atoms to form a mixture of edge and corner-sharing CrO6 octahedra. The corner-sharing octahedra tilt angles range from 0–62°. There are a spread of Cr–O bond distances ranging from 1.96–2.20 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded to one Li1+ and three Cr+2.90+ atoms to form distorted OLiCr3 tetrahedra that share a cornercorner with one OCr6 octahedra, a cornercorner with one OLiCr3 tetrahedra, corners with four equivalent OCr4 trigonal pyramids, and an edgeedge with one OCr6 octahedra. The corner-sharing octahedral tilt angles are 6°. In the second O2- site, O2- is bonded in a rectangular see-saw-like geometry to four Cr+2.90+ atoms. In the third O2- site, O2- is bonded in a distorted see-saw-like geometry to four Cr+2.90+ atoms. In the fourth O2- site, O2- is bonded to four Cr+2.90+ atoms to form OCr4 trigonal pyramids that share corners with two equivalent OLiCr3 tetrahedra, a cornercorner with one OCr4 trigonal pyramid, an edgeedge with one OCr6 octahedra, and an edgeedge with one OCr4 trigonal pyramid. In the fifth O2- site, O2- is bonded in a see-saw-like geometry to four Cr+2.90+ atoms. In the sixth O2- site, O2- is bonded to six Cr+2.90+ atoms to form OCr6 octahedra that share corners with two equivalent OLiCr3 tetrahedra, edges with two equivalent OLiCr3 tetrahedra, and edges with four equivalent OCr4 trigonal pyramids.

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Materials Data on Au2S by Materials Project

Au2S is Cuprite structured and crystallizes in the cubic Pn-3m space group. The structure is three-dimensional. Au1+ is bonded in a linear geometry to two equivalent S2- atoms. Both Au–S bond lengths are 2.32 Å. S2- is bonded to four equivalent Au1+ atoms to form corner-sharing SAu4 tetrahedra.

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Materials Data on Cs2Se by Materials Project

Cs2Se is Cuprite structured and crystallizes in the cubic Pn-3m space group. The structure is three-dimensional. Cs1+ is bonded in a linear geometry to two equivalent Se2- atoms. Both Cs–Se bond lengths are 3.41 Å. Se2- is bonded to four equivalent Cs1+ atoms to form corner-sharing SeCs4 tetrahedra.

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Materials Data on Cd2P by Materials Project

Cd2P is Cuprite structured and crystallizes in the cubic Pn-3m space group. The structure is three-dimensional. Cd is bonded in a linear geometry to two equivalent P atoms. Both Cd–P bond lengths are 2.53 Å. P is bonded to four equivalent Cd atoms to form corner-sharing PCd4 tetrahedra.

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Materials Data on Ca2Br2F by Materials Project

Ca2Br2F crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one Ca2Br2F cluster. Ca is bonded in a linear geometry to one Br and one F atom. The Ca–Br bond length is 2.55 Å. The Ca–F bond length is 2.15 Å. Br is bonded in a single-bond geometry to one Ca atom. F is bonded in a linear geometry to two equivalent Ca atoms.

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Materials Data on TbTe2 by Materials Project

TbTe2 crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one TbTe2 cluster. Tb4+ is bonded in a linear geometry to two equivalent Te2- atoms. Both Tb–Te bond lengths are 3.05 Å. Te2- is bonded in a single-bond geometry to one Tb4+ atom.

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Materials Data on Sr2HBr2 by Materials Project

Sr2HBr2 crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one Sr2HBr2 cluster. Sr is bonded in a linear geometry to one H and one Br atom. The Sr–H bond length is 2.29 Å. The Sr–Br bond length is 2.71 Å. H is bonded in a linear geometry to two equivalent Sr atoms. Br is bonded in a single-bond geometry to one Sr atom.

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Materials Data on AsSXeNF10 by Materials Project

XeAsNSF10 crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of eight XeAsNSF10 clusters. Xe is bonded in a linear geometry to one N and one F atom. The Xe–N bond length is 2.18 Å. The Xe–F bond length is 2.69 Å. As is bonded in an octahedral geometry to six F atoms. There are a spread of As–F bond distances ranging from 1.76–1.83 Å. N is bonded in a distorted bent 120 degrees geometry to one Xe and one S atom. The N–S bond length is 1.57 Å. S is bonded in a trigonal bipyramidal geometry to one N and four F atoms. There are a spread of S–F bond distances ranging from 1.56–1.62 Å. There are ten inequivalent F sites. In the first F site, F is bonded in a single-bond geometry to one S atom. In the second F site, F is bonded in a single-bond geometry to one As atom. In the third F site, F is bonded in a single-bond geometry to one As atom. In the fourth F site, F is bonded in a single-bond geometry to one S atom. In the fifth F site, F is bonded in a single-bond geometry to one S atom. In the sixth F site, F is bonded in a single-bond geometry to one S atom. In the seventh F site, F is bonded in a single-bond geometry to one As atom. In the eighth F site, F is bonded in a single-bond geometry to one Xe and one As atom. In the ninth F site, F is bonded in a single-bond geometry to one As atom. In the tenth F site, F is bonded in a single-bond geometry to one As atom.

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Materials Data on Ca2HCl2 by Materials Project

Ca2HCl2 crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one Ca2HCl2 cluster. Ca is bonded in a linear geometry to one H and one Cl atom. The Ca–H bond length is 2.11 Å. The Ca–Cl bond length is 2.39 Å. H is bonded in a linear geometry to two equivalent Ca atoms. Cl is bonded in a single-bond geometry to one Ca atom.

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Materials Data on Sm2Cl2O by Materials Project

Sm2OCl2 crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one Sm2OCl2 cluster. Sm2+ is bonded in a linear geometry to one O2- and one Cl1- atom. The Sm–O bond length is 2.13 Å. The Sm–Cl bond length is 2.52 Å. O2- is bonded in a linear geometry to two equivalent Sm2+ atoms. Cl1- is bonded in a single-bond geometry to one Sm2+ atom.

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Materials Data on La2I2O by Materials Project

La2OI2 crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one La2OI2 cluster. La2+ is bonded in a linear geometry to one O2- and one I1- atom. The La–O bond length is 2.11 Å. The La–I bond length is 2.98 Å. O2- is bonded in a linear geometry to two equivalent La2+ atoms. I1- is bonded in a single-bond geometry to one La2+ atom.

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Materials Data on Ca2HBr2 by Materials Project

Ca2HBr2 crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one Ca2HBr2 cluster. Ca is bonded in a linear geometry to one H and one Br atom. The Ca–H bond length is 2.10 Å. The Ca–Br bond length is 2.54 Å. H is bonded in a linear geometry to two equivalent Ca atoms. Br is bonded in a single-bond geometry to one Ca atom.

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Materials Data on Nd2Br2O by Materials Project

Nd2OBr2 crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one Nd2OBr2 cluster. Nd2+ is bonded in a linear geometry to one O2- and one Br1- atom. The Nd–O bond length is 2.15 Å. The Nd–Br bond length is 2.72 Å. O2- is bonded in a linear geometry to two equivalent Nd2+ atoms. Br1- is bonded in a single-bond geometry to one Nd2+ atom.

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