Geometry & MOs

Info

ID:	235654
PubChem CID:	92710325
Reduced:	SN2O2H18C21 (1)
Stoich.:	AB2C2D18E21 (1)
Weight, g/mol:	394.088434
ΔH_f, kcal/mol:	-0.76
Dipole, Da:	2.43
IP(EA), eV:	-8.86(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-benzoyl-N-(4-chloro-2-fluorophenyl)-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

C1[C@@H](N(C2=CC=CC=C21)C(=O)C3=CC=CC=C3)C(=O)NCC4=CC=CS4

DOS

IR

Vibrations