Geometry & MOs

Info

ID:	56598
PubChem CID:	17487149
Reduced:	OS2N4C15H16 (1)
Stoich.:	AB2C4D15E16 (1)
Weight, g/mol:	366.067428
ΔH_f, kcal/mol:	45.04
Dipole, Da:	3.44
IP(EA), eV:	-8.47(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-N-(2-methyl-1,3-benzothiazol-6-yl)-2-oxochromene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)NC(=O)CC2=CSC(=N2)C3=CC=CS3

DOS

IR

Vibrations