Formula |
C23H18N4 |
IUPAC Name |
8,8-bis(4-pyridylmethyl)-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene |
Molecular Mass |
350.416 g·mol−1 |
Heat of Formation |
539.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.21 ± 1.08 D |
Volume |
428.5 Å 3 |
Surface Area |
318.76 Å 2 |
HOMO Energy |
-9.52 ± 0.55 eV |
LUMO Energy |
-0.97 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 5,5-bis(4-pyridinylmethyl)-5h-cyclopenta(2,1-b-3,4-b')dipyridine
- 5h-cyclopenta(2,1-b-3,4-b')dipyridine, 5,5-bis(4-pyridinylmethyl)-
- exp 9121
- x 9121
- x-9121
- x9121
|
CAS Number(s) |
|
InChIKey |
FJYRSJDIZKTXKB-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
N
|
|
|