Geometry & MOs

Info

ID:	72833
PubChem CID:	48416596
Reduced:	SN3O3C16H21 (1)
Stoich.:	AB3C3D16E21 (1)
Weight, g/mol:	339.158292
ΔH_f, kcal/mol:	-104.58
Dipole, Da:	4.79
IP(EA), eV:	-9.1(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)CCC(=O)C2=CC=CS2)N3CCNC3=O

DOS

IR

Vibrations