Geometry & MOs

Info

ID:	386743
PubChem CID:	134982760
Reduced:	IO2C14H21 (1)
Stoich.:	AB2C14D21 (1)
Weight, g/mol:	148.125201
ΔH_f, kcal/mol:	-62.8
Dipole, Da:	2.79
IP(EA), eV:	-8.96(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-methyl-6-methylidene-1,2,3,3a,4,5-hexahydroindene

Drug info:

PubChemData

Smile

CC(C)(C/C=C/CC(=O)OC)C/C=C/C=C\I

DOS

IR

Vibrations