Geometry & MOs

Info

ID:	169629
PubChem CID:	75127981
Reduced:	NOC4H5 (5)
Stoich.:	ABC4D5 (5)
Weight, g/mol:	474.065235
ΔH_f, kcal/mol:	-185.27
Dipole, Da:	7.08
IP(EA), eV:	-9.69(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[5-(1,3-benzodioxol-5-ylmethylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2-(3-chlorophenoxy)propanamide

Drug info:

PubChemData

Smile

CCCCN1C(C(C(=O)NC1=O)N(C)C(=O)CCN2C(=O)C3=CC=CC=C3C2=O)N

DOS

IR

Vibrations