Geometry & MOs

Info

ID:	22898
PubChem CID:	599593
Reduced:	O3Cl4H6C14 (1)
Stoich.:	A3B4C6D14 (1)
Weight, g/mol:	363.904155
ΔH_f, kcal/mol:	-82.96
Dipole, Da:	3.41
IP(EA), eV:	-9.81(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4-dichloro-6-formylphenyl) 3,4-dichlorobenzoate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(=O)OC2=C(C=C(C=C2Cl)Cl)C=O)Cl)Cl

DOS

IR

Vibrations