Geometry & MOs

Info

ID:	358470
PubChem CID:	127296066
Reduced:	SO2N5C15H25 (1)
Stoich.:	AB2C5D15E25 (1)
Weight, g/mol:	367.25834
ΔH_f, kcal/mol:	-73.69
Dipole, Da:	3.68
IP(EA), eV:	-8.86(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-3-(1-piperidin-1-ylpropan-2-yl)urea

Drug info:

PubChemData

Smile

CCC1=NC(=CS1)CNC(=O)NCCC(=O)N2CCN(CC2)C

DOS

IR

Vibrations