Crystallography Open Database

Information card for entry 7247603

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Coordinates	7247603.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H48 N2 O2
Calculated formula	C32 H48 N2 O2
Title of publication	Linker size dependent mechanical properties of di-imine based molecular crystals
Authors of publication	Manoharan, Deepak; Ahmad, Shamim; Tothadi, Srinu; Emmerling, Franziska; Bhattacharya, Biswajit; Ghosh, Soumyajit
Journal of publication	CrystEngComm
Year of publication	2023
Journal volume	25
Journal issue	46
Pages of publication	6416 - 6423
a	18.8769 ± 0.0008 Å
b	6.1559 ± 0.0002 Å
c	26.9215 ± 0.0011 Å
α	90°
β	106.511 ± 0.003°
γ	90°
Cell volume	2999.4 ± 0.2 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	4
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	0.0583
Residual factor for significantly intense reflections	0.0512
Weighted residual factors for significantly intense reflections	0.1326
Weighted residual factors for all reflections included in the refinement	0.1405
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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