Geometry & MOs

Info

ID:	272369
PubChem CID:	103740592
Reduced:	F2N3O3C12H15 (1)
Stoich.:	A2B3C3D12E15 (1)
Weight, g/mol:	273.056112
ΔH_f, kcal/mol:	-119.05
Dipole, Da:	5.02
IP(EA), eV:	-9.12(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-2,6-difluoro-N-methyl-3-nitrobenzamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=C(C=CC(=C1F)[N+](=O)[O-])F)N(C)C

DOS

IR

Vibrations