Geometry & MOs

Info

ID:	354435
PubChem CID:	127286879
Reduced:	O3N4C20H28 (1)
Stoich.:	A3B4C20D28 (1)
Weight, g/mol:	388.214427
ΔH_f, kcal/mol:	-94.11
Dipole, Da:	4.19
IP(EA), eV:	-8.71(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methylsulfonylpiperidin-3-yl)-3-[(4-pyrrolidin-1-yloxan-4-yl)methyl]urea

Drug info:

PubChemData

Smile

C1CC(OC1)C(=O)NC2=CC=CC(=C2)CNC(=O)N3CCN(CC3)C4CC4

DOS

IR

Vibrations