Geometry & MOs

Info

ID:	367266
PubChem CID:	127324043
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	329.221561
ΔH_f, kcal/mol:	-51.01
Dipole, Da:	3.11
IP(EA), eV:	-8.92(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpyrrolidin-3-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)urea

Drug info:

PubChemData

Smile

C1CC(C2=C(C1)OC=C2)NC(=O)NC3CCN(C3)C4CC4

DOS

IR

Vibrations