Geometry & MOs

Info

ID:	144880
PubChem CID:	53427494
Reduced:	ClO2C11H11 (1)
Stoich.:	AB2C11D11 (1)
Weight, g/mol:	178.998535
ΔH_f, kcal/mol:	-62.6
Dipole, Da:	3.86
IP(EA), eV:	-9.73(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-methoxyimino-3-oxobutanoic acid

Drug info:

PubChemData

Smile

C=CC(CC(=O)O)C1=CC=CC=C1Cl

DOS

IR

Vibrations