Geometry & MOs

Info

ID:	277424
PubChem CID:	103828421
Reduced:	SF2N3O4C10H13 (1)
Stoich.:	AB2C3D4E10F13 (1)
Weight, g/mol:	276.092163
ΔH_f, kcal/mol:	-158.89
Dipole, Da:	8.26
IP(EA), eV:	-9.22(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-[2-(2-methoxyethoxy)ethyl]-4-nitroaniline

Drug info:

PubChemData

Smile

CS(=O)(=O)NCCCNC1=C(C=C(C=C1F)[N+](=O)[O-])F

DOS

IR

Vibrations