Geometry & MOs

Info

ID:	131227
PubChem CID:	51177460
Reduced:	ClN2S2O3C16H17 (1)
Stoich.:	AB2C2D3E16F17 (1)
Weight, g/mol:	327.147058
ΔH_f, kcal/mol:	-59.61
Dipole, Da:	1.9
IP(EA), eV:	-9.14(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(4-methylphenoxy)acetamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=CC=CC(=C1)C(=O)N(CC=C)CC2=CC=C(S2)Cl

DOS

IR

Vibrations