Crystallography Open Database

Information card for entry 7720618

7720617 << 7720618 >> 7720619

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Coordinates	7720618.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H47 Cl N2 O Zn
Calculated formula	C36 H47 Cl N2 O Zn
Title of publication	Synthesis, Structural Characterization and Rigidity Dependent Dual Luminescence Behavior of High-Energy Phosphorescent Zinc(II) Cyclic (Alkyl)(Amino)carbene Complexes
Authors of publication	Mitra, Mousree; Mrózek, Ondřej; Belyaev, Andrey; Janiak, Lars; Marian, Christel Maria; Steffen, Andreas
Journal of publication	Dalton Transactions
Year of publication	2026
a	9.7009 ± 0.0003 Å
b	11.0231 ± 0.0004 Å
c	17.5518 ± 0.0006 Å
α	90.022 ± 0.001°
β	98.147 ± 0.001°
γ	95.831 ± 0.001°
Cell volume	1848.12 ± 0.11 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0372
Residual factor for significantly intense reflections	0.0313
Weighted residual factors for significantly intense reflections	0.0776
Weighted residual factors for all reflections included in the refinement	0.0802
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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