Crystallography Open Database

Information card for entry 7719073

7719072 << 7719073 >> 7719074

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Coordinates	7719073.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H63 Cl4 Mn N4 O14
Calculated formula	C62 H63 Cl4 Mn N4 O14
Title of publication	Mn(III) porphyrins as photosensitizers: structural, photophysical and anticancer studies.
Authors of publication	Bora, Bidisha; Das, Namisha; Sultana, Jakia Parbin; Raza, Md Kausar; Goswami, Tridib K.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	30
Pages of publication	11743 - 11756
a	12.7394 ± 0.0002 Å
b	9.4803 ± 0.0001 Å
c	26.7201 ± 0.0004 Å
α	90°
β	98.566 ± 0.001°
γ	90°
Cell volume	3191.08 ± 0.08 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0594
Residual factor for significantly intense reflections	0.0536
Weighted residual factors for significantly intense reflections	0.1531
Weighted residual factors for all reflections included in the refinement	0.1582
Goodness-of-fit parameter for all reflections included in the refinement	1.076
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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