Geometry & MOs

Info

ID:	279514
PubChem CID:	103844194
Reduced:	FN2O2C13H15 (1)
Stoich.:	AB2C2D13E15 (1)
Weight, g/mol:	258.111676
ΔH_f, kcal/mol:	-30.45
Dipole, Da:	8.99
IP(EA), eV:	-9.1(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(cyclopenten-1-yl)ethylamino]-5-nitropyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1CC=C(C1)CCNC2=C(C=C(C=C2)[N+](=O)[O-])F

DOS

IR

Vibrations