Geometry & MOs

Info

ID:	72742
PubChem CID:	48416497
Reduced:	ClN3O3C15H18 (1)
Stoich.:	AB3C3D15E18 (1)
Weight, g/mol:	406.146347
ΔH_f, kcal/mol:	-118.67
Dipole, Da:	7.26
IP(EA), eV:	-9.02(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-thiophen-2-ylquinoline-4-carbonyl)piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations