Geometry & MOs

Info

ID:	216169
PubChem CID:	85085826
Reduced:	OC16H28 (1)
Stoich.:	AB16C28 (1)
Weight, g/mol:	236.214016
ΔH_f, kcal/mol:	-87.12
Dipole, Da:	1.99
IP(EA), eV:	-9.28(1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-6-(2,2,4-trimethylcyclopent-3-en-1-yl)hept-4-en-3-ol

Drug info:

PubChemData

Smile

CC(C)(C)C1CCC(CC1)(C2CCCC=C2)O

DOS

IR

Vibrations