Geometry & MOs

Info

ID:	345236
PubChem CID:	127268996
Reduced:	SO2N4C14H20 (1)
Stoich.:	AB2C4D14E20 (1)
Weight, g/mol:	345.216475
ΔH_f, kcal/mol:	-72.64
Dipole, Da:	2.85
IP(EA), eV:	-8.74(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-3-(2-oxopiperidin-3-yl)urea

Drug info:

PubChemData

Smile

C1CCC2=C(CC1)SC(=N2)NC(=O)NC3CCCNC3=O

DOS

IR

Vibrations