Geometry & MOs

Info

ID:	262506
PubChem CID:	103297431
Reduced:	FN3O4C13H14 (1)
Stoich.:	AB3C4D13E14 (1)
Weight, g/mol:	352.98113
ΔH_f, kcal/mol:	-117.14
Dipole, Da:	8.67
IP(EA), eV:	-9.9(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromopyridin-2-yl)-2-fluoro-3-methyl-5-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1F)C(=O)N2CCCNC(=O)C2)[N+](=O)[O-]

DOS

IR

Vibrations