Geometry & MOs

Info

ID:	182301
PubChem CID:	76873393
Reduced:	ON3C13H21 (1)
Stoich.:	AB3C13D21 (1)
Weight, g/mol:	242.105528
ΔH_f, kcal/mol:	-5.41
Dipole, Da:	4.76
IP(EA), eV:	-8.72(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(pyrrolidine-1-carbonyl)-4aH-quinolin-4-one

Drug info:

PubChemData

Smile

C1C(C(NN1)C2=CC=CC=C2)CNCCCO

DOS

IR

Vibrations