Geometry & MOs

Info

ID:	413045
PubChem CID:	135085989
Reduced:	NSO2H15C17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	238.050905
ΔH_f, kcal/mol:	-12.91
Dipole, Da:	5.51
IP(EA), eV:	-8.71(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-methoxy-1-methylindole-2-carboxamide

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=C2)OC)SC(=CC1=O)C3=CC=CC=C3

DOS

IR

Vibrations