Geometry & MOs

Info

ID:	31409
PubChem CID:	855684
Reduced:	SO2N3C18H19 (1)
Stoich.:	AB2C3D18E19 (1)
Weight, g/mol:	333.078327
ΔH_f, kcal/mol:	-30.04
Dipole, Da:	1.4
IP(EA), eV:	-8.5(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)NC(=O)C2CC2)C(=O)NC3=CC4=C(CCC4)C=C3

DOS

IR

Vibrations