Crystallography Open Database

Information card for entry 7238930

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Coordinates	7238930.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H29 Cl5 Mo N3 O4
Calculated formula	C15.001 H29 Cl5 Mo N3 O4
Title of publication	Lactam/MoCl5 interaction in CH2Cl2: synthesis and X-ray characterization of protonated δ-valerolactam salts
Authors of publication	Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano
Journal of publication	RSC Advances
Year of publication	2013
Journal volume	3
Journal issue	25
Pages of publication	10007
a	9.2987 ± 0.0008 Å
b	11.7668 ± 0.001 Å
c	22.2829 ± 0.0018 Å
α	90°
β	101.262 ± 0.001°
γ	90°
Cell volume	2391.2 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0285
Residual factor for significantly intense reflections	0.0234
Weighted residual factors for significantly intense reflections	0.0531
Weighted residual factors for all reflections included in the refinement	0.0555
Goodness-of-fit parameter for all reflections included in the refinement	1.02
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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