Crystallography Open Database

Information card for entry 7247973

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Coordinates	7247973.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H9 Br Hg I2 N2 O
Calculated formula	C12 H9 Br Hg I2 N2 O
Title of publication	A strategy for obtaining isostructurality despite structural diversity in coordination compounds
Authors of publication	Amani, Vahid; Esmaeili, Maryam; Norouzi, Fataneh; Khavasi, Hamid Reza
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	4
Pages of publication	543 - 556
a	25.3903 ± 0.0015 Å
b	14.1304 ± 0.0006 Å
c	9.1996 ± 0.0006 Å
α	90°
β	99.658 ± 0.005°
γ	90°
Cell volume	3253.8 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0862
Residual factor for significantly intense reflections	0.064
Weighted residual factors for significantly intense reflections	0.1406
Weighted residual factors for all reflections included in the refinement	0.1517
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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