1-[(1S,6R,7R)-5-Methyl-3,4-Diaza-2-Phosphatricyclo[5.2.1.0~2,6~]Deca-4,8-Dien-3-Yl]Ethanone

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Formula C10H13N2OP
IUPAC Name 1-[(1s,6r,7r)-5-methyl-3,4-diaza-2-phosphatricyclo[5.2.1.0 2,6 ]deca-4,8-dien-3-yl]ethanone
Molecular Mass 208.197 g·mol−1
Heat of Formation 25.2 ± 16.7 kJ·mol−1
Dipole Moment 5.76 ± 1.08 D
Volume 245.82 Å 3
Surface Area 221.52 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy 1.93 ± eV
Point Group Symmetry C1
InChIKey SDIKVBOSOGGCGN-KSQLKPTDSA-N
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