Geometry & MOs

Info

ID:	270157
PubChem CID:	103630842
Reduced:	ClSN2O3H11C13 (1)
Stoich.:	ABC2D3E11F13 (1)
Weight, g/mol:	303.067762
ΔH_f, kcal/mol:	-62.44
Dipole, Da:	2.06
IP(EA), eV:	-8.44(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1,3-benzodioxole-5-carboxamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C(=C2)C(=O)NCC3=CC=C(S3)Cl)N

DOS

IR

Vibrations