Geometry & MOs

Info

ID:	72953
PubChem CID:	48416721
Reduced:	Cl2O2N3C17H21 (1)
Stoich.:	A2B2C3D17E21 (1)
Weight, g/mol:	358.211724
ΔH_f, kcal/mol:	-95.97
Dipole, Da:	1.49
IP(EA), eV:	-9.3(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(1-pyrimidin-2-ylpiperidine-3-carbonyl)piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)CCC2=C(C=C(C=C2)Cl)Cl)N3CCNC3=O

DOS

IR

Vibrations