Geometry & MOs

Info

ID:	350397
PubChem CID:	127277759
Reduced:	SN2O3C20H28 (1)
Stoich.:	AB2C3D20E28 (1)
Weight, g/mol:	390.161329
ΔH_f, kcal/mol:	-128.72
Dipole, Da:	2.58
IP(EA), eV:	-8.94(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]-3-propanoyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)NC2=CC=CC(=C2)COC3CCCCC3

DOS

IR

Vibrations