(1R,2R,3As,5S,5Ar,8S,8As,10As,10Bs,10Cs)-1,8-Diisocyano-1,2,5,8-Tetramethylhexadecahydropyrene
Properties
Property | Value |
---|---|
Formula | C22H32N2 |
IUPAC Name | (2r,3r,3as,5as,6s,8ar,9s,10as,10bs,10cs)-3,6-diisocyano-2,3,6,9-tetramethyl-1,2,3a,4,5,5a,7,8,8a,9,10,10a,10b,10c-tetradecahydropyrene |
Molecular Mass | 324.503 g·mol−1 |
Heat of Formation | 79.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.03 ± 1.08 D |
Volume | 447.64 Å 3 |
Surface Area | 346.39 Å 2 |
HOMO Energy | -10.03 ± 0.55 eV |
LUMO Energy | 5.57 ± eV |
Point Group Symmetry | C1 |
Synonyms |
|
CAS Number(s) |
|
InChIKey | XLVAONKBFLGZSE-OXEUSEQRSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N |