Geometry & MOs

Info

ID:	69490
PubChem CID:	47193450
Reduced:	SCl2N2O3C12H14 (1)
Stoich.:	AB2C2D3E12F14 (1)
Weight, g/mol:	275.199762
ΔH_f, kcal/mol:	-127.51
Dipole, Da:	5.18
IP(EA), eV:	-9.52(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methylpropyl)-3-(4-piperidin-1-ylphenyl)urea

Drug info:

PubChemData

Smile

CN(C1CCS(=O)(=O)C1)C(=O)NC2=CC(=CC(=C2)Cl)Cl

DOS

IR

Vibrations