Geometry & MOs

Info

ID:	277436
PubChem CID:	103828496
Reduced:	F2O2N3C13H17 (1)
Stoich.:	A2B2C3D13E17 (1)
Weight, g/mol:	254.050298
ΔH_f, kcal/mol:	-85.01
Dipole, Da:	7.61
IP(EA), eV:	-8.87(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-(furan-3-ylmethyl)-4-nitroaniline

Drug info:

PubChemData

Smile

CCN1CCCC(C1)NC2=C(C=C(C=C2F)[N+](=O)[O-])F

DOS

IR

Vibrations