17-Chloroacetylajmaline

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Properties Simple | Detailed

Formula C22H27ClN2O3
IUPAC Name (17r,21alpha)-21-hydroxyajmalan-17-yl chloroacetate
Molecular Mass 402.914 g·mol−1
Heat of Formation -425.6 ± 16.7 kJ·mol−1
Dipole Moment 1.44 ± 1.08 D
Volume 463.47 Å 3
Surface Area 369.85 Å 2
HOMO Energy -8.34 ± 0.55 eV
LUMO Energy 3.25 ± eV
Point Group Symmetry C1
InChIKey LAHDERDHXJFFJU-ZWNKPRIXSA-N
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Elements H C N O Cl