Geometry & MOs

Info

ID:	382896
PubChem CID:	134974327
Reduced:	OC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	372.375602
ΔH_f, kcal/mol:	-88.52
Dipole, Da:	1.94
IP(EA), eV:	-10.14(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R,10S,13R,17S)-10,13-dimethyl-17-octyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene

Drug info:

PubChemData

Smile

CCCCCC(=O)/C=C/C(=C)CCO

DOS

IR

Vibrations