Geometry & MOs

Info

ID:	352238
PubChem CID:	127283320
Reduced:	SN4O4C15H22 (1)
Stoich.:	AB4C4D15E22 (1)
Weight, g/mol:	340.109293
ΔH_f, kcal/mol:	-147.54
Dipole, Da:	5.25
IP(EA), eV:	-9.71(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-1,1-dioxo-1,4-thiazinane-4-carboxamide

Drug info:

PubChemData

Smile

CN(CCC1=CC=CC=N1)C(=O)CNC(=O)N2CCS(=O)(=O)CC2

DOS

IR

Vibrations