(3β,11S,13β,19Alpha)-1,2-Didehydrocrinan-3,11-Diol

Molecule SVG Image

Properties Simple | Detailed

Formula C16H17NO4
IUPAC Name (3alpha,11r,13beta,19alpha)-1,2-didehydrocrinan-3,11-diol
Molecular Mass 287.310 g·mol−1
Heat of Formation -441.9 ± 16.7 kJ·mol−1
Dipole Moment 2.19 ± 1.08 D
Volume 321.18 Å 3
Surface Area 266.82 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -0.28 ± eV
Point Group Symmetry C1
InChIKey KWAOMPWGIIXDPH-KCXZSRPNSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N