Geometry & MOs

Info

ID:	272371
PubChem CID:	103740605
Reduced:	F2N3O4C12H13 (1)
Stoich.:	A2B3C4D12E13 (1)
Weight, g/mol:	286.076513
ΔH_f, kcal/mol:	-161.44
Dipole, Da:	4.76
IP(EA), eV:	-10.03(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-3-nitro-N-(oxan-4-yl)benzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations