Formula |
C34H50N8O3 |
IUPAC Name |
2-(2-cyanoethynyl)-n-[4-[2-(cyclopropylmethylamino)ethynyl-ethynyl-amino]phenyl]-4-hydroxy-but-3-ynamide; n-(isocyanatomethyl)-n-methyl-ethynamine; molecular nitrogen |
Molecular Mass |
618.813 g·mol−1 |
Heat of Formation |
-257.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.84 ± 1.08 D |
Volume |
776.52 Å 3 |
Surface Area |
651.19 Å 2 |
HOMO Energy |
-8.06 ± 0.55 eV |
LUMO Energy |
-0.92 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
SXNJFOWDRLKDSF-STROYTFGSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
Wikipedia
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
O
N
|
|
|