Geometry & MOs

Info

ID:	145107
PubChem CID:	53462863
Reduced:	O4C19H30 (1)
Stoich.:	A4B19C30 (1)
Weight, g/mol:	450.201794
ΔH_f, kcal/mol:	-181.88
Dipole, Da:	1.93
IP(EA), eV:	-10.35(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(15-acetyl-3,3,4-trifluoro-10,14-dimethyl-16-methylidene-7-oxo-15-pentacyclo[9.7.0.02,4.05,10.014,18]octadec-5-enyl) acetate

Drug info:

PubChemData

Smile

CC(=C)C(=O)OC.CC(=C)C(=O)OC1CC2CCC1(C2(C)C)C

DOS

IR

Vibrations