Geometry & MOs

Info

ID:	240796
PubChem CID:	93617612
Reduced:	SO2N3C17H21 (1)
Stoich.:	AB2C3D17E21 (1)
Weight, g/mol:	348.150764
ΔH_f, kcal/mol:	-40.41
Dipole, Da:	2.53
IP(EA), eV:	-8.71(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(1R,2R)-2-methylcyclohexyl]oxyethyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide

Drug info:

PubChemData

Smile

C[C@H]1CN(CCO1)C2=NC=C(C=C2)CNC(=O)C3=C(C=CS3)C

DOS

IR

Vibrations