Geometry & MOs

Info

ID:	34295
PubChem CID:	7890643
Reduced:	N2S2O5C13H14 (1)
Stoich.:	A2B2C5D13E14 (1)
Weight, g/mol:	372.095751
ΔH_f, kcal/mol:	-146.68
Dipole, Da:	4.78
IP(EA), eV:	-9.37(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-2-oxoethyl] 2-hydroxybenzoate

Drug info:

PubChemData

Smile

CC1=NC(=CS1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)OC

DOS

IR

Vibrations