Crystallography Open Database

Information card for entry 7711199

Preview

Coordinates	7711199.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	mer-[InCl3(3,5-Me2-pzH)3(H2O)]
Chemical name	InCl3(N2C5H8)3(H2O)
Formula	C15 H25 Cl3 In N6 O0.5
Calculated formula	C15 H25 Cl3 In N6 O0.5
Title of publication	Mononuclear, hexanuclear and polymeric indium(iii) pyrazolido complexes; structural characterization, dynamic solution studies and luminescent properties
Authors of publication	Herrera, Susana; Rivero, Kennett I.; Guzmán, Alexis; Cedeño, Jonathan; Miksovska, Jaroslava; Raptis, Raphael G.
Journal of publication	Dalton Transactions
Year of publication	2022
a	9.3323 ± 0.0019 Å
b	16.936 ± 0.003 Å
c	13.806 ± 0.003 Å
α	90°
β	92.046 ± 0.005°
γ	90°
Cell volume	2180.7 ± 0.8 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	6
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	0.0631
Residual factor for significantly intense reflections	0.0437
Weighted residual factors for significantly intense reflections	0.0851
Weighted residual factors for all reflections included in the refinement	0.0914
Goodness-of-fit parameter for all reflections included in the refinement	1.121
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
277723 (current)	2022-09-08	cif/ Adding structures of 7711195, 7711196, 7711197, 7711198, 7711199, 7711200, 7711201, 7711202 via cif-deposit CGI script.	7711199.cif