Geometry & MOs

Info

ID:	56419
PubChem CID:	17425401
Reduced:	N3O3C17H17 (1)
Stoich.:	A3B3C17D17 (1)
Weight, g/mol:	332.040168
ΔH_f, kcal/mol:	-79.68
Dipole, Da:	3.77
IP(EA), eV:	-8.68(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C)C)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)N

DOS

IR

Vibrations