Geometry & MOs

Info

ID:

429209

PubChem CID:

135169059

Reduced:

O3N4C28H34 (1)

Stoich.:

A3B4C28D34 (1)

Weight, g/mol:

463.25834

ΔHf, kcal/mol:

-59.25

Dipole, Da:

7.12

IP(EA), eV:

 -9.76(-0.61)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2S,3R)-1-N-[(1R)-1-cyclohexylpropyl]-2-N-methyl-4-oxo-2-N-pyridin-4-yl-3-(pyridin-4-ylmethyl)azetidine-1,2-dicarboxamide

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)C(=O)[C@@H]2[C@H](C(=O)N2C(=O)N[C@@H](C3CCCCC3)C4CC4)CC5=CC=NC=C5

DOS

IR

Vibrations