Geometry & MOs

Info

ID:	276125
PubChem CID:	103820760
Reduced:	ClN2O4C10H11 (1)
Stoich.:	AB2C4D10E11 (1)
Weight, g/mol:	234.100442
ΔH_f, kcal/mol:	-81.17
Dipole, Da:	4.37
IP(EA), eV:	-10.19(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-hydroxypropan-2-yl]-2-oxo-1,3-dihydroindole-5-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](CO)NC(=O)C1=C(C(=CC=C1)Cl)[N+](=O)[O-]

DOS

IR

Vibrations