Geometry & MOs

Info

ID:	352688
PubChem CID:	127283777
Reduced:	ON2C13H22 (1)
Stoich.:	AB2C13D22 (1)
Weight, g/mol:	257.119798
ΔH_f, kcal/mol:	-45.32
Dipole, Da:	1.06
IP(EA), eV:	-8.68(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl]-1,4-thiazinane 1-oxide

Drug info:

PubChemData

Smile

CC1CCCC(N1CC2=NC(=C(O2)C)C)C

DOS

IR

Vibrations