Formula |
C16H21N3O |
IUPAC Name |
(11s)-11-methyl-10-(3-methylbut-2-enyl)-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one |
Molecular Mass |
271.357 g·mol−1 |
Heat of Formation |
-26.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.27 ± 1.08 D |
Volume |
341.15 Å 3 |
Surface Area |
298.32 Å 2 |
HOMO Energy |
-8.48 ± 0.55 eV |
LUMO Energy |
-0.10 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (+)-4,5,6,7-tetrahydro-5-(s)-methyl-6-(3-methyl-2-butenyl)imidazo-[4,5,1-jk][1,4]-benzodiazepin- 2(ih)-one
- r80902
|
InChIKey |
LOFKLFWOTPCHJG-LBPRGKRZSA-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
|
|
|