Geometry & MOs

Info

ID:	354811
PubChem CID:	127287571
Reduced:	OSN2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	286.168128
ΔH_f, kcal/mol:	-28.0
Dipole, Da:	4.4
IP(EA), eV:	-8.98(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2S)-2-(3-methyl-3,4-dihydro-2H-quinoline-1-carbonyl)pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1C2=C(CCN1C(=O)C3CCN(C3)C)SC=C2

DOS

IR

Vibrations