Crystallography Open Database

Information card for entry 2020593

2020592 << 2020593 >> 2020594

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Structure parameters

Chemical name	Di-μ-chlorido-bis[(η^2^-2-allyl-4-methoxy-5-{[(propan-2-yloxy)carbonyl]methoxy}phenyl-κ<i>C</i>^1^)platinum(II)]
Formula	C30 H38 Cl2 O8 Pt2
Calculated formula	C30 H38 Cl2 O8 Pt2
SMILES	c12cc(c(cc1C[CH]1=[CH2][Pt]321[Cl][Pt]12(c4cc(c(cc4C[CH]1=[CH2]2)OC)OCC(=O)OC(C)C)[Cl]3)OC)OCC(=O)OC(C)C
Title of publication	Crystallization experiments with the dinuclear chelate ring complex di-μ-chlorido-bis[(η^2^-2-allyl-4-methoxy-5-{[(propan-2-yloxy)carbonyl]methoxy}phenyl-κ<i>C</i>^1^)platinum(II)]
Authors of publication	Nguyen Thi Thanh, Chi; Pham Van, Thong; Le Thi Hong, Hai; Van Meervelt, Luc
Journal of publication	Acta Crystallographica Section C
Year of publication	2016
Journal volume	72
Journal issue	10
Pages of publication	758 - 764
a	13.56 ± 0.0003 Å
b	7.98332 ± 0.00019 Å
c	15.8057 ± 0.0004 Å
α	90°
β	104.815 ± 0.003°
γ	90°
Cell volume	1654.15 ± 0.07 Å³
Cell temperature	200 ± 0.1 K
Ambient diffraction temperature	200 ± 0.1 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0183
Residual factor for significantly intense reflections	0.0154
Weighted residual factors for significantly intense reflections	0.0358
Weighted residual factors for all reflections included in the refinement	0.0371
Goodness-of-fit parameter for all reflections included in the refinement	1.082
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
186846 (current)	2016-09-30	cif/ hkl/ Adding structures of 2020591, 2020592, 2020593 via cif-deposit CGI script.	2020593.cif 2020593.hkl