Subtle Crossover from C−H···O to SO···CO Short Contacts in the Association of Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate upon Formation of Pseudopolymorphs
Authors of publication
Manoj, K.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S.
Journal of publication
Crystal Growth & Design
Year of publication
2006
Journal volume
6
Journal issue
6
Pages of publication
1485
a
15.966 ± 0.003 Å
b
11.068 ± 0.003 Å
c
22.264 ± 0.005 Å
α
90°
β
108.676 ± 0.004°
γ
90°
Cell volume
3727.1 ± 1.5 Å3
Cell temperature
133 ± 2 K
Ambient diffraction temperature
133 ± 2 K
Number of distinct elements
4
Space group number
4
Hermann-Mauguin space group symbol
P 1 21 1
Hall space group symbol
P 2yb
Residual factor for all reflections
0.0992
Residual factor for significantly intense reflections
0.0704
Weighted residual factors for significantly intense reflections
0.1771
Weighted residual factors for all reflections included in the refinement
0.1975
Goodness-of-fit parameter for all reflections included in the refinement
