Geometry & MOs

Info

ID:	23897
PubChem CID:	607035
Reduced:	ClNOSH10C15 (1)
Stoich.:	ABCDE10F15 (1)
Weight, g/mol:	287.017163
ΔH_f, kcal/mol:	19.15
Dipole, Da:	4.58
IP(EA), eV:	-8.81(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-phenyl-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

DOS

IR

Vibrations