Diethyl (1-{[(2-Chloroethyl)(Nitroso)Carbamoyl]Amino}Ethyl)Phosphonate

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Properties Simple | Detailed

Formula C9H19ClN3O5P
IUPAC Name 1-(2-chloroethyl)-3-[(1r)-1-diethoxyphosphorylethyl]-1-nitroso-urea
Molecular Mass 315.691 g·mol−1
Heat of Formation -1015.9 ± 16.7 kJ·mol−1
Dipole Moment 3.28 ± 1.08 D
Volume 364.76 Å 3
Surface Area 318.63 Å 2
HOMO Energy -9.34 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
InChIKey YAKWPXVTIGTRJH-MRVPVSSYSA-N
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Elements C Cl H O N P