Vitamin K1 2,3-Oxide

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Properties Simple | Detailed

Formula C31H46O3
IUPAC Name (1ar,7as)-7a-methyl-1a-[(e,7r,11r)-3,7,11,15-tetramethylhexadec-2-enyl]naphtho[2,3-b]oxirene-2,7-dione
Molecular Mass 466.695 g·mol−1
Heat of Formation -614.4 ± 16.7 kJ·mol−1
Dipole Moment 2.25 ± 1.08 D
Volume 642.47 Å 3
Surface Area 438.39 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy 1.70 ± eV
Point Group Symmetry C1
InChIKey KUTXFBIHPWIDJQ-BTPXSFBUSA-N
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Elements H C O