Geometry & MOs

Info

ID:

130006

PubChem CID:

51074584

Reduced:

SN2O3C13H26 (1)

Stoich.:

AB2C3D13E26 (1)

Weight, g/mol:

299.199762

ΔHf, kcal/mol:

-156.5

Dipole, Da:

1.45

IP(EA), eV:

-8.84(0.78)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-methyl-5-[[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CN(CCS(=O)(=O)CCC(=O)N)C1CCCCCC1

DOS

IR

Vibrations