Geometry & MOs

Info

ID:

377532

PubChem CID:

134223589

Reduced:

N5O6C32H39 (1)

Stoich.:

A5B6C32D39 (1)

Weight, g/mol:

589.290034

ΔHf, kcal/mol:

-159.43

Dipole, Da:

7.58

IP(EA), eV:

 -8.72(-0.53)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[2-[[4-[1-(2-hydroxyethyl)piperidin-4-yl]cyclohexa-1,5-diene-1-carbonyl]amino]pyridin-4-yl]oxy-6-(2-methoxyethoxy)-N-methylindole-1-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)N1C=CC2=CC(=C(C=C21)OCCOC)OC3=CC(=NC=C3)NC(=O)C4=CC=C(CC4)C5CCN(CC5)CCO

DOS

IR

Vibrations