Geometry & MOs

Info

ID:	142800
PubChem CID:	53093669
Reduced:	ClN2O2C21H23 (1)
Stoich.:	AB2C2D21E23 (1)
Weight, g/mol:	426.094662
ΔH_f, kcal/mol:	-68.83
Dipole, Da:	7.2
IP(EA), eV:	-8.72(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(4-chlorobenzoyl)-2,3-dihydroindol-5-yl]methyl]-2,6-difluorobenzamide

Drug info:

PubChemData

Smile

CC(C)CC(=O)NCC1=CC2=C(C=C1)N(CC2)C(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations