Unknown

Dataset Information

0

N,N-Dimethyl-N',N''-bis-(2-methyl-phenyl)phospho-ric triamide mono-hydrate.


ABSTRACT: In the title compound, C(16)H(22)N(3)OP·H(2)O, the P atom adopts a distorted tetra-hedral environment with the bond angles around the P atom in the range 99.98?(7)-116.20?(7)°. The P-N bond length in the [(CH(3))(2)N]P(O) fragment [1.6392?(14)?Å] is slightly shorter than two other P-N bonds [1.6439?(15) and 1.6530?(14)?Å]. In the (CH(3))(2)NP(O) fragment, one of the methyl groups is syn to the P=O bond, whereas the other one is anti to the P=O bond [C-N-P=O torsion angles = 4.80?(17) and -174.57?(15)°]. In the crystal, the water mol-ecules form hydrogen bonds to the O atoms of the P=O bond of two different mol-ecules and act as acceptors for the two amino H atoms of the same mol-ecule. As a result, chains parallel to [010] are formed.

SUBMITTER: Eslami F 

PROVIDER: S-EPMC3435677 | biostudies-literature | 2012 Sep

REPOSITORIES: biostudies-literature

altmetric image

Publications

N,N-Dimethyl-N',N''-bis-(2-methyl-phenyl)phospho-ric triamide mono-hydrate.

Eslami Farnaz F   Pourayoubi Mehrdad M   Yousefi Mohammad M   Rheingold Arnold L AL   Golen James A JA  

Acta crystallographica. Section E, Structure reports online 20120804 Pt 9


In the title compound, C(16)H(22)N(3)OP·H(2)O, the P atom adopts a distorted tetra-hedral environment with the bond angles around the P atom in the range 99.98 (7)-116.20 (7)°. The P-N bond length in the [(CH(3))(2)N]P(O) fragment [1.6392 (14) Å] is slightly shorter than two other P-N bonds [1.6439 (15) and 1.6530 (14) Å]. In the (CH(3))(2)NP(O) fragment, one of the methyl groups is syn to the P=O bond, whereas the other one is anti to the P=O bond [C-N-P=O torsion angles = 4.80 (17) and -174.57  ...[more]

Similar Datasets

| S-EPMC3120462 | biostudies-literature
| S-EPMC3239060 | biostudies-literature
| S-EPMC3239040 | biostudies-literature
| S-EPMC3051506 | biostudies-literature
| S-EPMC3100001 | biostudies-literature
| S-EPMC3201409 | biostudies-literature
| S-EPMC3247428 | biostudies-literature
| S-EPMC3238882 | biostudies-other
| S-EPMC3089276 | biostudies-literature
| S-EPMC2983404 | biostudies-literature