O,S-Dimethyl O-(4-Nitrophenyl) Phosphorothioate

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Properties Simple | Detailed

Formula C8H10NO5PS
IUPAC Name 1-[methoxy(methylsulfanyl)phosphoryl]oxy-4-nitro-benzene
Molecular Mass 263.207 g·mol−1
Heat of Formation -696.8 ± 16.7 kJ·mol−1
Dipole Moment 8.90 ± 1.08 D
Volume 281.9 Å 3
Surface Area 258.02 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy -1.10 ± eV
Point Group Symmetry C1
InChIKey IVNMMKOOGWCFRS-HNNXBMFYSA-N
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