Geometry & MOs

Info

ID:	262502
PubChem CID:	103297325
Reduced:	FN2O5C13H15 (1)
Stoich.:	AB2C5D13E15 (1)
Weight, g/mol:	289.086269
ΔH_f, kcal/mol:	-176.6
Dipole, Da:	6.29
IP(EA), eV:	-10.42(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-3-methyl-N-(4-methylpyridin-3-yl)-5-nitrobenzamide

Drug info:

PubChemData

Smile

CCOC(=O)CCNC(=O)C1=C(C(=CC(=C1)[N+](=O)[O-])C)F

DOS

IR

Vibrations