X-ray diffraction analysis of (Ph sub(2)PO) sub(2)

The title compound (Ph2PO)2 is analyzed by single crystal X-ray diffraction analysis. The crystals are monoclinic, space group P2(1)/n with a = 9.5112(19) Aa, b = 11.161(2) Aa, c = 9.5487(19) Aa, alpha = 90 degree , beta = 91.65(3) degree , gamma = 90 degree , V = 1013.2(3) Aa super(3), Z = 2, F( su...

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Published inMolecular crystals and liquid crystals (Philadelphia, Pa. : 2003) Vol. 624; no. 1; pp. 271 - 274
Main Authors Gao, Wei, Sun, De-Mei, Sun, Yan-Jun
Format Journal Article
LanguageEnglish
Published 02.01.2016
Subjects
Crystals
Diffraction
Hydrogen bonds
Liquid crystals
Reflection
Single crystals
Solid state
X-rays
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Summary:The title compound (Ph2PO)2 is analyzed by single crystal X-ray diffraction analysis. The crystals are monoclinic, space group P2(1)/n with a = 9.5112(19) Aa, b = 11.161(2) Aa, c = 9.5487(19) Aa, alpha = 90 degree , beta = 91.65(3) degree , gamma = 90 degree , V = 1013.2(3) Aa super(3), Z = 2, F( sub(000)) = 420, Dc = 1.319 g cm super(-3), mu = 0.232 mm super(-1), the final R = 0.0818, and wR = 0.2259. A total of 7954 reflections were collected, of which 1758 were independent (R sub(int) = 0.0542). In the crystal packing diagram, intermolecular C-H...O hydrogen bonds stabilize the solid state of the title compound.
Bibliography:ObjectType-Article-1
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ISSN:1542-1406
1563-5287
DOI:10.1080/15421406.2015.1044716