Geometry & MOs

Info

ID:	72796
PubChem CID:	48416554
Reduced:	BrClN3O3C16H19 (1)
Stoich.:	ABC3D3E16F19 (1)
Weight, g/mol:	393.181919
ΔH_f, kcal/mol:	-105.46
Dipole, Da:	1.68
IP(EA), eV:	-9.33(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)acetyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)COC2=C(C=C(C=C2)Cl)Br)N3CCNC3=O

DOS

IR

Vibrations