Geometry & MOs

Info

ID:

362665

PubChem CID:

127309054

Reduced:

N3O3C20H27 (1)

Stoich.:

A3B3C20D27 (1)

Weight, g/mol:

365.123169

ΔHf, kcal/mol:

-79.39

Dipole, Da:

4.42

IP(EA), eV:

-8.69(-0.05)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-(3-methyl-1-thiophen-2-ylbutyl)-2-(1,3-thiazol-2-yl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC2CN(CCN2C1)C(=O)NC(C3CC3)C4=CC5=C(C=C4)OCCO5

DOS

IR

Vibrations