Geometry & MOs

Info

ID:	272763
PubChem CID:	103755983
Reduced:	BrON2C13H17 (1)
Stoich.:	ABC2D13E17 (1)
Weight, g/mol:	331.99605
ΔH_f, kcal/mol:	-15.3
Dipole, Da:	4.42
IP(EA), eV:	-10.14(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-5-fluorophenyl)-1H-indole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1(CC1)CNC(=O)C2=CC(=NC=C2)Br

DOS

IR

Vibrations