Geometry & MOs

Info

ID:	9613
PubChem CID:	91556
Reduced:	O4C25H30 (1)
Stoich.:	A4B25C30 (1)
Weight, g/mol:	394.214409
ΔH_f, kcal/mol:	-85.41
Dipole, Da:	4.28
IP(EA), eV:	-8.27(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

20-methoxy-4,8,13,17-tetramethyl-20-oxoicosa-2,4,6,8,10,12,14,16,18-nonaenoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations