Geometry & MOs

Info

ID:	277437
PubChem CID:	103828512
Reduced:	F2N2O3H8C11 (1)
Stoich.:	A2B2C3D8E11 (1)
Weight, g/mol:	273.128883
ΔH_f, kcal/mol:	-77.57
Dipole, Da:	7.25
IP(EA), eV:	-9.25(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-difluoro-4-nitrophenyl)-N',N'-dimethylbutane-1,4-diamine

Drug info:

PubChemData

Smile

C1=COC=C1CNC2=C(C=C(C=C2F)[N+](=O)[O-])F

DOS

IR

Vibrations