N,N-Dimethyl-N′,N″-bis-(2-methylphenyl)phosphoric triamide monohydrate

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Abstract

In the title compound, C16H22N3OP· H2O, 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 [(CH3)2N]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 (CH3)2NP(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 molecules form hydrogen bonds to the O atoms of the P=O bond of two different molecules and act as acceptors for the two amino H atoms of the same molecule. As a result, chains parallel to [010] are formed.

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Eslami, F., Pourayoubi, M., Yousefi, M., Rheingold, A. L., & Golen, J. A. (2012). N,N-Dimethyl-N′,N″-bis-(2-methylphenyl)phosphoric triamide monohydrate. Acta Crystallographica Section E: Structure Reports Online, 68(9). https://doi.org/10.1107/S1600536812033995

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