Geometry & MOs

Info

ID:	365904
PubChem CID:	127319168
Reduced:	ON4C24H32 (1)
Stoich.:	AB4C24D32 (1)
Weight, g/mol:	372.252526
ΔH_f, kcal/mol:	-15.24
Dipole, Da:	3.87
IP(EA), eV:	-8.96(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-3-(1-phenylcyclohexyl)urea

Drug info:

PubChemData

Smile

C1CCC(CC1)(C2=CC=CC=C2)NC(=O)NC3CCN(CC3)CC4=CC=CC=N4

DOS

IR

Vibrations