Geometry & MOs

Info

ID:	15136
PubChem CID:	430535
Reduced:	O5C28H46 (1)
Stoich.:	A5B28C46 (1)
Weight, g/mol:	462.334525
ΔH_f, kcal/mol:	-221.78
Dipole, Da:	1.41
IP(EA), eV:	-9.13(-2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-5,6-dimethoxy-3-(3,7,11,15-tetramethylhexadec-2-enyl)cyclohexa-2,5-diene-1,4-dione

Drug info:

PubChemData

Smile

CC(C)CCCC(C)CCCC(C)CCCC(=CCC1=C(C(=O)C(=C(C1=O)OC)OC)O)C

DOS

IR

Vibrations