6-[2-(2H-Tetrazol-5-Yl)Ethyl]Decahydro-3-Isoquinolinecarboxylic Acid
Properties
Property | Value |
---|---|
Formula | C13H21N5O2 |
IUPAC Name | (3r,4ar,6r,8ar)-6-[2-(2h-tetrazol-5-yl)ethyl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid |
Molecular Mass | 279.338 g·mol−1 |
Heat of Formation | -176.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.33 ± 1.08 D |
Volume | 336.4 Å 3 |
Surface Area | 293.19 Å 2 |
HOMO Energy | -9.34 ± 0.55 eV |
LUMO Energy | -0.67 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZXFRFPSZAKNPQQ-LMLFDSFASA-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 |