Geometry & MOs

Info

ID:	352733
PubChem CID:	127283822
Reduced:	SN2O4C15H20 (1)
Stoich.:	AB2C4D15E20 (1)
Weight, g/mol:	310.098728
ΔH_f, kcal/mol:	-123.89
Dipole, Da:	1.59
IP(EA), eV:	-8.4(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethyl)-2-(1-oxo-1,4-thiazinan-4-yl)acetamide

Drug info:

PubChemData

Smile

C1COC2=C(C=C(C=C2)NC(=O)CN3CCS(=O)CC3)OC1

DOS

IR

Vibrations