Geometry & MOs

Info

ID:	210740
PubChem CID:	80850493
Reduced:	O2N5C11H15 (1)
Stoich.:	A2B5C11D15 (1)
Weight, g/mol:	263.138225
ΔH_f, kcal/mol:	-45.09
Dipole, Da:	3.23
IP(EA), eV:	-9.21(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-4-[2-(ethylamino)pyrimidin-4-yl]piperazine-2,6-dione

Drug info:

PubChemData

Smile

CC1(C(=O)NC(=O)CN1C2=NC(=NC=C2)NC)C

DOS

IR

Vibrations