Geometry & MOs

Info

ID:

269324

PubChem CID:

103616994

Reduced:

SN2C11H20 (1)

Stoich.:

AB2C11D20 (1)

Weight, g/mol:

226.15037

ΔHf, kcal/mol:

-7.85

Dipole, Da:

1.61

IP(EA), eV:

-9.44(-0.47)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(2-methyl-1,3-thiazol-5-yl)octan-1-amine

Drug info:

PubChemData

Smile

CCCCCCC(C1=CN=C(S1)C)N

DOS

IR

Vibrations