Geometry & MOs

Info

ID:

201856

PubChem CID:

79593890

Reduced:

SN2O3C13H28 (1)

Stoich.:

AB2C3D13E28 (1)

Weight, g/mol:

295.145344

ΔHf, kcal/mol:

-158.71

Dipole, Da:

5.92

IP(EA), eV:

-9.29(0.58)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

methyl 4-methyl-2-(2-propan-2-yloxyethylsulfonylamino)pentanoate

Drug info:

PubChemData

Smile

CC(C)OCCS(=O)(=O)N(C)C1CCCCC1CN

DOS

IR

Vibrations