Geometry & MOs

Info

ID:	355972
PubChem CID:	127290962
Reduced:	SO3N6C16H28 (1)
Stoich.:	AB3C6D16E28 (1)
Weight, g/mol:	305.140927
ΔH_f, kcal/mol:	-90.23
Dipole, Da:	6.34
IP(EA), eV:	-9.07(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methylsulfonylpiperidin-3-yl)-3-(oxan-3-yl)urea

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CN2CCN(CC2)C(=O)NC3CCCN(C3)S(=O)(=O)C

DOS

IR

Vibrations