Geometry & MOs

Info

ID:

89403

PubChem CID:

49961463

Reduced:

N3O4C12H15 (1)

Stoich.:

A3B4C12D15 (1)

Weight, g/mol:

398.220557

ΔHf, kcal/mol:

-137.36

Dipole, Da:

4.05

IP(EA), eV:

-9.18(-0.25)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(2,3-dimethylphenoxy)-N-[2-[[2-(2,3-dimethylphenoxy)acetyl]amino]propyl]acetamide

Drug info:

PubChemData

Smile

COC(=O)NNC(=O)CCC(=O)NC1=CC=CC=C1

DOS

IR

Vibrations