Geometry & MOs

Info

ID:

182074

PubChem CID:

76838693

Reduced:

N2O3C26H30 (1)

Stoich.:

A2B3C26D30 (1)

Weight, g/mol:

572.311104

ΔHf, kcal/mol:

-58.99

Dipole, Da:

3.38

IP(EA), eV:

 -8.32(-0.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-hydroxy-3-[1-[2-(6-methyl-1H-indol-3-yl)ethyl-[[3-(morpholine-4-carbonyl)pyrazolidin-4-yl]methyl]amino]-2,3-dihydro-1H-inden-5-yl]prop-2-enamide

Drug info:

PubChemData

Smile

COCCN(CCC1=CNC2=CC=CC=C21)C3CCC4=C3C=CC(=C4)C=CC(=O)OC

DOS

IR

Vibrations