Geometry & MOs

Info

ID:	171843
PubChem CID:	75433060
Reduced:	ON3F4C14H17 (1)
Stoich.:	AB3C4D14E17 (1)
Weight, g/mol:	275.070619
ΔH_f, kcal/mol:	-238.82
Dipole, Da:	7.06
IP(EA), eV:	-9.58(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-fluoropyridin-2-yl)-3-methyl-4-nitrobenzamide

Drug info:

PubChemData

Smile

C1CN(CCC1NCC2=CC(=C(C=C2)F)C(F)(F)F)C(=O)N

DOS

IR

Vibrations