Geometry & MOs

Info

ID:	232546
PubChem CID:	87576396
Reduced:	ClOH8C9 (2)
Stoich.:	ABC8D9 (2)
Weight, g/mol:	350.318481
ΔH_f, kcal/mol:	-22.89
Dipole, Da:	4.56
IP(EA), eV:	-9.06(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,4E)-tricosa-2,4-dienoic acid

Drug info:

PubChemData

Smile

C1CC1COC2=CC=C(C=C2)C(C=O)C3=CC(=C(C=C3)Cl)Cl

DOS

IR

Vibrations