Geometry & MOs

Info

ID:	85437
PubChem CID:	49875098
Reduced:	NSCl2O4H13C16 (1)
Stoich.:	ABC2D4E13F16 (1)
Weight, g/mol:	344.056385
ΔH_f, kcal/mol:	-143.9
Dipole, Da:	4.33
IP(EA), eV:	-9.28(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[(5-chloro-2-oxo-3H-indole-1-carbonyl)amino]benzoate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)C2=C(SC(=C2)CCC(=O)O)NC(=O)CCl)Cl

DOS

IR

Vibrations