Geometry & MOs

Info

ID:

186944

PubChem CID:

77508021

Reduced:

N4O5C29H44 (1)

Stoich.:

A4B5C29D44 (1)

Weight, g/mol:

511.304621

ΔHf, kcal/mol:

-205.51

Dipole, Da:

2.55

IP(EA), eV:

 -8.27(-0.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-(1-cyclopropylpiperidin-4-yl)-N-[1-(6-ethoxy-3-oxo-3a,5,6,6a-tetrahydrofuro[3,2-b]pyrrol-4-yl)-3-methyl-1-oxopentan-2-yl]benzamide

Drug info:

PubChemData

Smile

CCCN1CCN(CC1)C2=CC=C(C=C2)C(=O)NC(CC(C)(C)C)C(=O)N3CC(C4C3C(=O)CO4)OCC

DOS

IR

Vibrations