Geometry & MOs

Info

ID:	261442
PubChem CID:	103234265
Reduced:	ClO2N4C11H11 (1)
Stoich.:	AB2C4D11E11 (1)
Weight, g/mol:	267.012077
ΔH_f, kcal/mol:	-8.46
Dipole, Da:	5.56
IP(EA), eV:	-8.95(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-chloroanilino)methyl]thiophene-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=CC=C1NCCN2C=C(N=N2)C(=O)O)Cl

DOS

IR

Vibrations