Geometry & MOs

Info

ID:	179457
PubChem CID:	76485312
Reduced:	NO4C16H25 (1)
Stoich.:	AB4C16D25 (1)
Weight, g/mol:	565.393123
ΔH_f, kcal/mol:	-84.05
Dipole, Da:	2.1
IP(EA), eV:	-9.06(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxamide

Drug info:

PubChemData

Smile

COC1C2C3CC(C2(OC(C3=C)O1)CN4CCCCC4)O

DOS

IR

Vibrations