Geometry & MOs

Info

ID:	277420
PubChem CID:	103828407
Reduced:	F2N3O3H11C13 (1)
Stoich.:	A2B3C3D11E13 (1)
Weight, g/mol:	272.097249
ΔH_f, kcal/mol:	-79.01
Dipole, Da:	7.31
IP(EA), eV:	-9.31(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-4-nitro-N-[2-(oxolan-2-yl)ethyl]aniline

Drug info:

PubChemData

Smile

COC1=NC=CC(=C1)CNC2=C(C=C(C=C2F)[N+](=O)[O-])F

DOS

IR

Vibrations