Geometry & MOs

Info

ID:	33649
PubChem CID:	7887335
Reduced:	NSO5H13C14 (1)
Stoich.:	ABC5D13E14 (1)
Weight, g/mol:	369.067094
ΔH_f, kcal/mol:	-177.09
Dipole, Da:	3.37
IP(EA), eV:	-8.89(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl] 1-benzothiophene-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)NC(=O)COC(=O)C1=CC2=CC=CC=C2S1

DOS

IR

Vibrations