Geometry & MOs

Info

ID:	262169
PubChem CID:	103274600
Reduced:	BrFNO2H15C16 (1)
Stoich.:	ABCD2E15F16 (1)
Weight, g/mol:	346.0117
ΔH_f, kcal/mol:	-86.92
Dipole, Da:	6.19
IP(EA), eV:	-9.17(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-4-fluoro-2-methylphenyl)-1H-indole-6-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1NC(=O)CCOC2=CC=CC=C2)Br)F

DOS

IR

Vibrations