Geometry & MOs

Info

ID:	12879
PubChem CID:	147509
Reduced:	O2C21H28 (1)
Stoich.:	A2B21C28 (1)
Weight, g/mol:	312.20893
ΔH_f, kcal/mol:	-55.89
Dipole, Da:	4.72
IP(EA), eV:	-8.5(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-(4-methoxy-2,3,6-trimethylphenyl)-3,7-dimethylnona-2,4,6,8-tetraen-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1C=CC(=CC=CC(=CCO)C)C)C)C)OC

DOS

IR

Vibrations