Geometry & MOs

Info

ID:

299949

PubChem CID:

118043289

Reduced:

N3O3C19H24 (2)

Stoich.:

A3B3C19D24 (2)

Weight, g/mol:

410.12019

ΔHf, kcal/mol:

-180.89

Dipole, Da:

8.62

IP(EA), eV:

 -8.62(-0.8)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

ethyl 5-[6-(5-hydroxy-3-methyl-2-oxoimidazolidin-1-yl)-4-(trifluoromethyl)pyridin-3-yl]pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCN1CCN(CC1)C/C=C/C(=O)N2CCC(CC2)C3=NC(=C(C=C3)C(=O)N)OC4=CC=C(C=C4)OC5=CC=CC=C5

DOS

IR

Vibrations