Geometry & MOs

Info

ID:	1517
PubChem CID:	4630
Reduced:	ON2C12H18 (1)
Stoich.:	AB2C12D18 (1)
Weight, g/mol:	206.141913
ΔH_f, kcal/mol:	-1.4
Dipole, Da:	4.62
IP(EA), eV:	-9.08(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CCN(C1)CC#CCN2CCCC2=O

DOS

IR

Vibrations