Geometry & MOs

Info

ID:	364733
PubChem CID:	127316039
Reduced:	SO2N6C17H22 (1)
Stoich.:	AB2C6D17E22 (1)
Weight, g/mol:	371.141596
ΔH_f, kcal/mol:	-21.61
Dipole, Da:	7.03
IP(EA), eV:	-8.82(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(1H-imidazol-2-ylmethyl)piperazine-1-carbonyl]-2-methyl-4H-1,4-benzothiazin-3-one

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2=NC(=CS2)CC(=O)N3CCN(CC3)CC4=NC=CN4

DOS

IR

Vibrations