Geometry & MOs

Info

ID:	79449
PubChem CID:	49748683
Reduced:	NO4C22H25 (1)
Stoich.:	AB4C22D25 (1)
Weight, g/mol:	468.16787
ΔH_f, kcal/mol:	-135.06
Dipole, Da:	4.91
IP(EA), eV:	-9.32(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[[2-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-2-methoxyanilino]-2-oxoacetyl]amino]methyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C1CCC2(CC1)OCC(O2)CNC(=O)C3=CC=CC=C3OC4=CC=CC=C4

DOS

IR

Vibrations