Geometry & MOs

Info

ID:	358261
PubChem CID:	127295806
Reduced:	SO3N4C17H32 (1)
Stoich.:	AB3C4D17E32 (1)
Weight, g/mol:	347.187878
ΔH_f, kcal/mol:	-157.23
Dipole, Da:	5.37
IP(EA), eV:	-8.95(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[(1-methylsulfonylpiperidin-4-yl)methyl]-1-(oxan-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCC(CC1)CNC(=O)N2CCC(C2)N3CCCCC3

DOS

IR

Vibrations