Geometry & MOs

Info

ID:	329898
PubChem CID:	127246765
Reduced:	ON5C18H19 (1)
Stoich.:	AB5C18D19 (1)
Weight, g/mol:	302.210661
ΔH_f, kcal/mol:	49.04
Dipole, Da:	4.69
IP(EA), eV:	-8.49(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[2-(dimethylamino)pyridin-4-yl]pyrrolidin-1-yl]-1-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C2CCCN2C(=O)C3=NNC4=CC=CC=C43

DOS

IR

Vibrations