Geometry & MOs

Info

ID:	380362
PubChem CID:	134970786
Reduced:	YC10H17 (1)
Stoich.:	AB10C17 (1)
Weight, g/mol:	274.266051
ΔH_f, kcal/mol:	69.98
Dipole, Da:	8.22
IP(EA), eV:	-5.38(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,8aR)-3,4,8,8-tetramethyl-4-[(E)-3-methylpent-3-enyl]-1,2,3,6,7,8a-hexahydronaphthalene

Drug info:

PubChemData

Smile

CC(C)(C)C1CC[C-]=CC1.[Y]

DOS

IR

Vibrations