Geometry & MOs

Info

ID:	272337
PubChem CID:	103739991
Reduced:	N2F3O3H7C13 (1)
Stoich.:	A2B3C3D7E13 (1)
Weight, g/mol:	272.097249
ΔH_f, kcal/mol:	-133.13
Dipole, Da:	4.19
IP(EA), eV:	-9.48(-2.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-(3-methylbutyl)-3-nitrobenzamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)NC(=O)C2=C(C=CC(=C2F)[N+](=O)[O-])F

DOS

IR

Vibrations