Geometry & MOs

Info

ID:	217321
PubChem CID:	85087616
Reduced:	O3C23H28 (1)
Stoich.:	A3B23C28 (1)
Weight, g/mol:	352.24023
ΔH_f, kcal/mol:	-61.09
Dipole, Da:	4.25
IP(EA), eV:	-8.69(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,7-dimethyl-6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)octa-2,4,6-trienoic acid

Drug info:

PubChemData

Smile

CC12CCC3C(C1CCC24CCC(=O)O4)C=CC5=CC(=O)C(=C)CC35C

DOS

IR

Vibrations