Geometry & MOs

Info

ID:	15246
PubChem CID:	434577
Reduced:	O7C19H24 (1)
Stoich.:	A7B19C24 (1)
Weight, g/mol:	364.152203
ΔH_f, kcal/mol:	-285.62
Dipole, Da:	7.68
IP(EA), eV:	-9.8(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8-acetyloxy-3-hydroxy-6,9-dimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-3-yl)methyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCC1(C2CCC(=C)C3CC(C(=C)C3C2OC1=O)OC(=O)C)O

DOS

IR

Vibrations