Geometry & MOs

Info

ID:	69329
PubChem CID:	46530706
Reduced:	O4N5C21H27 (1)
Stoich.:	A4B5C21D27 (1)
Weight, g/mol:	349.175004
ΔH_f, kcal/mol:	-86.11
Dipole, Da:	4.04
IP(EA), eV:	-8.95(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-oxo-2-[4-(piperidine-1-carbonyl)piperazin-1-yl]ethyl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=NC(=NO1)COC2=CC=CC=C2C(=O)N3CCN(CC3)C(=O)N4CCCCC4

DOS

IR

Vibrations