Geometry & MOs

Info

ID:	169768
PubChem CID:	75144783
Reduced:	O2C17H24 (1)
Stoich.:	A2B17C24 (1)
Weight, g/mol:	290.151809
ΔH_f, kcal/mol:	-73.25
Dipole, Da:	4.33
IP(EA), eV:	-8.31(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,7-dimethylocta-2,6-dienyl)-4,5-dihydroxybenzoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations