Geometry & MOs

Info

ID:	272376
PubChem CID:	103740653
Reduced:	F2N2O3H10C11 (1)
Stoich.:	A2B2C3D10E11 (1)
Weight, g/mol:	322.043499
ΔH_f, kcal/mol:	-100.24
Dipole, Da:	4.43
IP(EA), eV:	-10.23(-1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-methyl-N-(2-methylsulfonylethyl)-3-nitrobenzamide

Drug info:

PubChemData

Smile

CC1CC1NC(=O)C2=C(C=CC(=C2F)[N+](=O)[O-])F

DOS

IR

Vibrations