Geometry & MOs

Info

ID:	329857
PubChem CID:	127246724
Reduced:	N5C15H21 (1)
Stoich.:	A5B15C21 (1)
Weight, g/mol:	318.205576
ΔH_f, kcal/mol:	58.6
Dipole, Da:	5.17
IP(EA), eV:	-8.41(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-(methylamino)pyridin-4-yl]pyrrolidin-1-yl]-3-morpholin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C2CCCN2CC3=NC=CN3C

DOS

IR

Vibrations