Geometry & MOs

Info

ID:	11963
PubChem CID:	124342
Reduced:	O2C27H44 (1)
Stoich.:	A2B27C44 (1)
Weight, g/mol:	400.334131
ΔH_f, kcal/mol:	-125.4
Dipole, Da:	1.46
IP(EA), eV:	-8.82(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,8,13,17,21-pentamethyldocosa-4,8,12,16,20-pentaenoic acid

Drug info:

PubChemData

Smile

CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC(=O)O)C)C)C

DOS

IR

Vibrations