Geometry & MOs

Info

ID:	20803
PubChem CID:	585790
Reduced:	OC14H22 (2)
Stoich.:	AB14C22 (2)
Weight, g/mol:	412.334131
ΔH_f, kcal/mol:	-122.74
Dipole, Da:	0.63
IP(EA), eV:	-8.56(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[1-(6-hydroxy-5,6-dimethylhept-3-en-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol

Drug info:

PubChemData

Smile

CC(C=CC(C)C(C)(C)O)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C

DOS

IR

Vibrations