Geometry & MOs

Info

ID:	127199
PubChem CID:	50994276
Reduced:	N2O3F6H8C14 (1)
Stoich.:	A2B3C6D8E14 (1)
Weight, g/mol:	252.085855
ΔH_f, kcal/mol:	-314.82
Dipole, Da:	3.9
IP(EA), eV:	-9.75(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dinitro-5-pyrrolidin-1-ylaniline

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(F)(F)F)OC2=CC(=C(C(=C2)[N+](=O)[O-])N)C(F)(F)F

DOS

IR

Vibrations