Geometry & MOs

Info

ID:	147291
PubChem CID:	53786946
Reduced:	N2O5C11H14 (1)
Stoich.:	A2B5C11D14 (1)
Weight, g/mol:	303.033207
ΔH_f, kcal/mol:	-174.18
Dipole, Da:	5.9
IP(EA), eV:	-11.36(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloropropyl)-6,7-dihydro-3H-[1,4]dioxino[2,3-f][1,2]benzothiazole 1,1-dioxide

Drug info:

PubChemData

Smile

CCC(OCC)(OC(=O)CC#N)OC(=O)CC#N

DOS

IR

Vibrations