Geometry & MOs

Info

ID:	146283
PubChem CID:	53664422
Reduced:	Cl2O4H12C13 (1)
Stoich.:	A2B4C12D13 (1)
Weight, g/mol:	304.019489
ΔH_f, kcal/mol:	-137.88
Dipole, Da:	5.85
IP(EA), eV:	-9.95(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]-2-tritioacetic acid

Drug info:

PubChemData

Smile

CCC(=C)C(=O)C1=C(C(=C(C=C1)OC[14C](=O)O)Cl)Cl

DOS

IR

Vibrations