Geometry & MOs

Info

ID:	22364
PubChem CID:	596982
Reduced:	SN2O3C11H12 (1)
Stoich.:	AB2C3D11E12 (1)
Weight, g/mol:	252.056863
ΔH_f, kcal/mol:	-81.68
Dipole, Da:	1.23
IP(EA), eV:	-8.69(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-(6-methoxy-1,3-benzothiazol-2-yl)carbamate

Drug info:

PubChemData

Smile

CCOC(=O)NC1=NC2=C(S1)C=C(C=C2)OC

DOS

IR

Vibrations