Geometry & MOs

Info

ID:	263806
PubChem CID:	103399953
Reduced:	NSCl2O3H9C13 (1)
Stoich.:	ABC2D3E9F13 (1)
Weight, g/mol:	321.022642
ΔH_f, kcal/mol:	-95.03
Dipole, Da:	8.35
IP(EA), eV:	-9.49(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-methylthiophene-2-carbonyl)-2,3-dihydroindole-5-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CSC(=C1Cl)C(=O)NC2=C(C=CC(=C2)C(=O)O)Cl

DOS

IR

Vibrations