Geometry & MOs

Info

ID:	23659
PubChem CID:	605331
Reduced:	ClO3C6H6 (2)
Stoich.:	AB3C6D6 (2)
Weight, g/mol:	322.001094
ΔH_f, kcal/mol:	-225.37
Dipole, Da:	2.98
IP(EA), eV:	-9.38(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 3,6-dichloro-4,5-dimethoxybenzene-1,2-dicarboxylate

Drug info:

PubChemData

Smile

COC1=C(C(=C(C(=C1OC)Cl)C(=O)OC)C(=O)OC)Cl

DOS

IR

Vibrations