Geometry & MOs

Info

ID:	352751
PubChem CID:	127283840
Reduced:	S2O3N4C17H26 (1)
Stoich.:	A2B3C4D17E26 (1)
Weight, g/mol:	255.104148
ΔH_f, kcal/mol:	-67.56
Dipole, Da:	7.31
IP(EA), eV:	-8.57(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1,4-thiazinane 1-oxide

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3CCS(=O)CC3

DOS

IR

Vibrations