Geometry & MOs

Info

ID:	9128
PubChem CID:	86382
Reduced:	Cl3H3O4C5 (1)
Stoich.:	A3B3C4D5 (1)
Weight, g/mol:	231.909692
ΔH_f, kcal/mol:	-170.55
Dipole, Da:	2.88
IP(EA), eV:	-11.08(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-3-(dichloromethyl)but-2-enedioic acid

Drug info:

PubChemData

Smile

C(C(=C(C(=O)O)Cl)C(=O)O)(Cl)Cl

DOS

IR

Vibrations