Geometry & MOs

Info

ID:	10629
PubChem CID:	105780
Reduced:	NCl4O4H11C12 (1)
Stoich.:	AB4C4D11E12 (1)
Weight, g/mol:	374.941269
ΔH_f, kcal/mol:	-172.19
Dipole, Da:	4.48
IP(EA), eV:	-10.03(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,4,5-tetrachloro-6-(3-methoxypropylcarbamoyl)benzoic acid

Drug info:

PubChemData

Smile

COCCCNC(=O)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)O

DOS

IR

Vibrations