Geometry & MOs

Info

ID:	365466
PubChem CID:	127317885
Reduced:	O2N5C17H31 (1)
Stoich.:	A2B5C17D31 (1)
Weight, g/mol:	340.185903
ΔH_f, kcal/mol:	-82.44
Dipole, Da:	6.79
IP(EA), eV:	-8.81(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]urea

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)CCNC(=O)N2CCN(CC2)C3CCC3

DOS

IR

Vibrations