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Information card for entry 2241554
Preview
Coordinates | 2241554.cif |
---|---|
Structure factors | 2241554.hkl |
Original paper (by DOI) | HTML |
Common name | 1,2-Bis((benzylsulfanyl){2-[1-(2-hydroxyphenyl)ethylidene]hydrazin-1-ylidene}methyl)disulfane |
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Chemical name | 2-[1-(2-{(Benzylsulfanyl)[((benzylsulfanyl){2-[1-(2-hydroxyphenyl)ethylidene]hydrazin-1-ylidene}methyl)disulfanyl]methylidene}hydrazin-1-ylidene)ethyl]phenol |
Formula | C32 H30 N4 O2 S4 |
Calculated formula | C32 H30 N4 O2 S4 |
SMILES | S(/C(SS\C(SCc1ccccc1)=N/N=C(C)/c1c(O)cccc1)=N/N=C(/c1c(O)cccc1)C)Cc1ccccc1 |
Title of publication | Crystal structure of 1,2-bis((benzylsulfanyl){2-[1-(2-hydroxyphenyl)ethylidene]hydrazin-1-ylidene}methyl)disulfane |
Authors of publication | Islam, M. A. A. A. A.; Sheikh, M. C.; Islam, M. H.; Miyatake, R.; Zangrando, E. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2016 |
Journal volume | 72 |
Journal issue | 3 |
Pages of publication | 337 - 339 |
a | 10.5556 ± 0.0003 Å |
b | 11.0236 ± 0.0003 Å |
c | 15.5261 ± 0.0005 Å |
α | 75.9922 ± 0.0008° |
β | 71.9673 ± 0.0007° |
γ | 65.5889 ± 0.0007° |
Cell volume | 1550.67 ± 0.08 Å3 |
Cell temperature | 173 K |
Ambient diffraction temperature | 173 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for significantly intense reflections | 0.0342 |
Weighted residual factors for all reflections included in the refinement | 0.093 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
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