Geometry & MOs

Info

ID:	345515
PubChem CID:	127269815
Reduced:	O2N5C17H25 (1)
Stoich.:	A2B5C17D25 (1)
Weight, g/mol:	317.185175
ΔH_f, kcal/mol:	-72.91
Dipole, Da:	4.53
IP(EA), eV:	-8.6(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-oxopiperidin-3-yl)-3-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]urea

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=NC=CC(=C2)CNC(=O)NC3CCCNC3=O

DOS

IR

Vibrations