Geometry & MOs

Info

ID:	73547
PubChem CID:	48418094
Reduced:	O3N5C20H21 (1)
Stoich.:	A3B5C20D21 (1)
Weight, g/mol:	341.137556
ΔH_f, kcal/mol:	-18.36
Dipole, Da:	3.19
IP(EA), eV:	-9.21(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydroindol-1-yl)-N-[(2-hydroxy-5-nitrophenyl)methyl]propanamide

Drug info:

PubChemData

Smile

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CN(C)CC3=CC=CC=C3

DOS

IR

Vibrations