Geometry & MOs

Info

ID:	386067
PubChem CID:	134980681
Reduced:	OC20H34 (1)
Stoich.:	AB20C34 (1)
Weight, g/mol:	274.266051
ΔH_f, kcal/mol:	-85.58
Dipole, Da:	2.32
IP(EA), eV:	-9.2(1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aS,8aS)-4,4,8a-trimethyl-7-methylidene-8-[(E)-3-methylpent-3-enyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalene

Drug info:

PubChemData

Smile

C/C=C(\C)/CCC1C(=C)CC[C@@H]2[C@@]1(CCC[C@]2(C)CO)C

DOS

IR

Vibrations