Geometry & MOs

Info

ID:	362431
PubChem CID:	127307777
Reduced:	O2N4C19H28 (1)
Stoich.:	A2B4C19D28 (1)
Weight, g/mol:	268.153541
ΔH_f, kcal/mol:	-72.69
Dipole, Da:	4.67
IP(EA), eV:	-8.87(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,4-dimethylpiperazin-1-yl)-2-oxoethyl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)CC2CCN(CC2)C(=O)CC3=CN=CC=C3

DOS

IR

Vibrations