Geometry & MOs

Info

ID:	25207
PubChem CID:	620963
Reduced:	SN6H10C11 (1)
Stoich.:	AB6C10D11 (1)
Weight, g/mol:	258.11907
ΔH_f, kcal/mol:	136.31
Dipole, Da:	4.0
IP(EA), eV:	-9.22(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-phenyl-4a,5,8,8a-tetrahydro-4H-3,1-benzothiazin-2-imine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CSC2=NC(=NN3C2=NN=C3)N

DOS

IR

Vibrations