Geometry & MOs

Info

ID:	356145
PubChem CID:	127291181
Reduced:	SN2O4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	378.161329
ΔH_f, kcal/mol:	-142.68
Dipole, Da:	8.36
IP(EA), eV:	-8.9(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3,3-dimethylbutanoyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)C(=O)N2CSCC2C(=O)NCC3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations