Geometry & MOs

Info

ID:	275563
PubChem CID:	103816611
Reduced:	NO4C26H27 (1)
Stoich.:	AB4C26D27 (1)
Weight, g/mol:	307.99605
ΔH_f, kcal/mol:	-103.54
Dipole, Da:	5.08
IP(EA), eV:	-8.99(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-fluoro-N-(6-methylpyridin-3-yl)benzamide

Drug info:

PubChemData

Smile

C1CC1N(C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C5(CC6CCC5C6)C(=O)O

DOS

IR

Vibrations