Geometry & MOs

Info

ID:	279515
PubChem CID:	103844196
Reduced:	O2N4C13H14 (1)
Stoich.:	A2B4C13D14 (1)
Weight, g/mol:	233.116427
ΔH_f, kcal/mol:	54.9
Dipole, Da:	7.44
IP(EA), eV:	-9.8(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopenten-1-yl)ethyl]-3-nitropyridin-2-amine

Drug info:

PubChemData

Smile

C1CC=C(C1)CCNC2=C(C=C(C=N2)[N+](=O)[O-])C#N

DOS

IR

Vibrations