Geometry & MOs

Info

ID:	399635
PubChem CID:	135041396
Reduced:	OC8H12 (2)
Stoich.:	AB8C12 (2)
Weight, g/mol:	278.260966
ΔH_f, kcal/mol:	-58.02
Dipole, Da:	7.22
IP(EA), eV:	-9.0(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E)-3-methyl-1-[(2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]octa-2,7-dien-1-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations