Adrenaline
 
 
Introduction
3D Structure
Properties
Synthesis
Biol. Function
References and links

Author
ChemVis
Molecule of the Month
Molecule of the Month
Molecule of the Month
    
Molecular and Atomic Properties
Molecular Weight183.21 g/mol
Melting Point215 C
Water Solubility<0.01 g/100mL at 18 C
Standard Heat of Formation-439.17 kJ/mol
Molecular Polarizability18.676 A3
Effective Atomic Polarizability See separate page
Atomic -System Partial Charge See separate page

Bond Distances, Bond Angles and Torsional Angles
Measurement Click on the image to the left or here to load the VRML scene.

Click on the atoms in the VRML scene to calculate the bond distances and bond angles.
The VRML scene was created with the VRML File Creator for Chemical Structures. You can also create a VRML scene of your own structure files (go here).
Molecular Orbitals
65 molecular orbitals (36 occupied, 29 unoccupied)
HOMO LUMO
HOMO of adrenaline (MO Nr. 36) LUMO of adrenaline (MO Nr. 37)
MO Nr. (1-65) or HOMO & LUMO
The VRML scenes were created with the OrbVis online service. Select a molecular orbital (1-65) and press the Visualize button to obtain the VRML scene of the MO (System Requirements: JDK1.1 compatible browser + VRML2.0 plugin).
You can also create a VRML scene of your own structure files (go here).
IR/Raman Spectra and Normal Modes
Animated Normal Mode Click on the image on the left or here to get more information about IR/Raman spectra and normal modes (animated VRML scenes).


Last change: 1999-04-12
Frank.Oellien@chemie.uni-erlangen.de