Geometry & MOs

Info

ID:	235374
PubChem CID:	92310280
Reduced:	N2S2O3C19H22 (1)
Stoich.:	A2B2C3D19E22 (1)
Weight, g/mol:	390.107185
ΔH_f, kcal/mol:	-93.76
Dipole, Da:	7.64
IP(EA), eV:	-8.87(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-acetyl-N-(2-ethylphenyl)-2-methyl-2,3-dihydro-1,4-benzothiazine-6-sulfonamide

Drug info:

PubChemData

Smile

C[C@H]1CN(C2=C(S1)C=CC(=C2)S(=O)(=O)NC3=C(C=CC=C3C)C)C(=O)C

DOS

IR

Vibrations