Wolf W M, Bartczak T J
Institute of General Chemistry, Technical University of Lódź, Poland.
Acta Crystallogr C. 1989 Nov 15;45 ( Pt 11):1767-70. doi: 10.1107/s010827018900260x.
C11H15N2O4PSe, Mr = 349.2, monoclinic, P2(1)/c, a = 10.204(3), b = 19.891 (3), c = 6.823 (3) A, beta = 94.41 (3) degrees, U = 1380.8 A3, Z = 4, Dm = 1.66, Dx = 1.68 Mg m-3, Mo K alpha, lambda = 0.71069 A, mu = 3.05 mm-1, F(000) = 704, room temperature, R = 0.026 for 1755 observed reflections [I greater than 3 sigma (I)]. The dioxaphosphorinane ring adopts a flattened chair conformation with P = Se and P-N bonds in equatorial and axial positions respectively. The properties of the molecule are mainly governed by anomeric interactions between endocyclic oxygen lone pairs and antibonding orbitals of the axial P-N bond.