Geometry & MOs

Info

ID:	222574
PubChem CID:	85305553
Reduced:	OSeC20H38 (1)
Stoich.:	ABC20D38 (1)
Weight, g/mol:	373.225308
ΔH_f, kcal/mol:	-79.45
Dipole, Da:	5.04
IP(EA), eV:	-8.29(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8,11-dihydroxy-7-(hydroxymethyl)-6,13-dimethyl-7-azapentacyclo[10.8.0.02,9.05,9.013,18]icosa-14,17-dien-16-one

Drug info:

PubChemData

Smile

CC1CCC(C(C1)[Se](=O)C2CC(CCC2C(C)C)C)C(C)C

DOS

IR

Vibrations