Geometry & MOs

Info

ID:	66242
PubChem CID:	46500489
Reduced:	NOF3H10C15 (1)
Stoich.:	ABC3D10E15 (1)
Weight, g/mol:	346.168128
ΔH_f, kcal/mol:	-104.02
Dipole, Da:	2.28
IP(EA), eV:	-8.82(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dimethylanilino)-3-pyrrolidin-1-ylnaphthalene-1,4-dione

Drug info:

PubChemData

Smile

CC1=C2C(=C(C(=C(C2=NC3=CC=CC=C13)F)OC)F)F

DOS

IR

Vibrations