Geometry & MOs

Info

ID:	351597
PubChem CID:	127280489
Reduced:	O2N6C19H24 (1)
Stoich.:	A2B6C19D24 (1)
Weight, g/mol:	349.175004
ΔH_f, kcal/mol:	-3.41
Dipole, Da:	4.93
IP(EA), eV:	-9.31(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-oxo-2-[4-(2-pyrrolidin-1-ylacetyl)piperazin-1-yl]ethyl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1CCN(C1)CC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=NC=N4

DOS

IR

Vibrations