Geometry & MOs

Info

ID:	348095
PubChem CID:	127273157
Reduced:	O2N5C20H25 (1)
Stoich.:	A2B5C20D25 (1)
Weight, g/mol:	382.167477
ΔH_f, kcal/mol:	-18.15
Dipole, Da:	5.09
IP(EA), eV:	-8.53(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-cyclopentyloxypyridin-3-yl)-3-(1-methylsulfonylpiperidin-4-yl)urea

Drug info:

PubChemData

Smile

C1CCC(C1)OC2=NC=C(C=C2)NC(=O)N3CCN(CC3)C4=CC=CC=N4

DOS

IR

Vibrations