Geometry & MOs

Info

ID:	209253
PubChem CID:	80644351
Reduced:	ClNSO3C8H8 (1)
Stoich.:	ABCD3E8F8 (1)
Weight, g/mol:	295.006992
ΔH_f, kcal/mol:	-112.08
Dipole, Da:	7.17
IP(EA), eV:	-9.7(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-chlorothiophene-2-carbonyl)amino]-3-methylbenzoic acid

Drug info:

PubChemData

Smile

CC(C(=O)O)NC(=O)C1=C(C=CS1)Cl

DOS

IR

Vibrations