Information card for entry 2200311

Structure parameters

• Common name: Trichloro(sarcosinium) zinc(II) monohydrate
• Chemical name: Trichloro(sarcosinium) zinc(II) monohydrate
• Formula: C3 H10 Cl3 N O3 Zn
• Calculated formula: C3 H10 Cl3 N O3 Zn
• SMILES: [Zn](Cl)(Cl)(Cl)[O]=C(O)C[NH2+]C.O
• Title of publication: Trichloro(sarcosinio)zinc(II) monohydrate
• Authors of publication: Krishnakumar, R. V.; Subha Nandhini, M.; Natarajan, S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 5
• Pages of publication: m192 - m194
• a: 6.6181 ± 0.0012 Å
• b: 7.4989 ± 0.0011 Å
• c: 9.9 ± 0.004 Å
• α: 90°
• β: 92.62 ± 0.02°
• γ: 90°
• Cell volume: 490.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0179
• Residual factor for significantly intense reflections: 0.0173
• Weighted residual factors for all reflections included in the refinement: 0.0527
• Goodness-of-fit parameter for all reflections included in the refinement: 1.275
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes