Geometry & MOs

Info

ID:	367221
PubChem CID:	127323996
Reduced:	ON5C20H31 (1)
Stoich.:	AB5C20D31 (1)
Weight, g/mol:	345.216475
ΔH_f, kcal/mol:	-13.25
Dipole, Da:	4.86
IP(EA), eV:	-8.43(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpyrrolidin-3-yl)-3-[(2-morpholin-4-ylpyridin-4-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1CCN(CC1)C2=NC=C(C=C2)CNC(=O)NC3CCN(C3)C4CC4

DOS

IR

Vibrations