Geometry & MOs

Info

ID:	283351
PubChem CID:	103976648
Reduced:	N5C12H17 (1)
Stoich.:	A5B12C17 (1)
Weight, g/mol:	286.142976
ΔH_f, kcal/mol:	66.41
Dipole, Da:	1.78
IP(EA), eV:	-8.52(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(8-nitroquinolin-4-yl)pyrrolidin-3-yl]ethanamine

Drug info:

PubChemData

Smile

CC(C1CCN(C1)C2=NN3C=CC=CC3=N2)N

DOS

IR

Vibrations