14,14'-Diethylidene-10,17'-Bi(8,16-Diazahexacyclo[11.5.2.1~1,8~.0~2,7~.0~12,21~.0~16,19~]Henicosane)-2,2',4,4',6,6',10,10'-Octaene-9,9'-Dione
Properties
Property | Value |
---|---|
Formula | C42H42N4O2 |
IUPAC Name | (1r,1'r,12s,12's,13r,13'r,14e,14'e,17'r,19s,19's,21s,21's)-14,14'-diethylidene-10,17'-bi(8,16-diazahexacyclo[11.5.2.1 1,8 .0 2,7 .0 12,21 .0 16,19 ]henicosane)-2,2',4,4',6,6',10,10'-octaene-9,9'-dione |
Molecular Mass | 634.808 g·mol−1 |
Heat of Formation | 6338.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.60 ± 1.08 D |
Volume | 663.55 Å 3 |
Surface Area | 504.49 Å 2 |
HOMO Energy | -7.94 ± 0.55 eV |
LUMO Energy | -2.68 ± eV |
Point Group Symmetry | C1 |
InChIKey | VCDMHIARBYKHSB-AZTNQZEYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |