Geometry & MOs

Info

ID:	329868
PubChem CID:	127246735
Reduced:	ON2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	351.20591
ΔH_f, kcal/mol:	-56.81
Dipole, Da:	8.98
IP(EA), eV:	-8.18(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(methylamino)pyridin-4-yl]pyrrolidin-1-yl]-(2-pyrrolidin-1-ylpyridin-4-yl)methanone

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C2CCCN2C(=O)C3=CC4=C(CCCC4)NC3=O

DOS

IR

Vibrations