(4R,6Z)-4-Hydroxy-6-(Hydroxymethyl)-1-Methyl-1,3,4,8-Tetrahydro-5(2H)-Azocinone
Properties
Property | Value |
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Formula | C9H15NO3 |
IUPAC Name | (4r,6z)-4-hydroxy-6-(hydroxymethyl)-1-methyl-2,3,4,8-tetrahydroazocin-5-one |
Molecular Mass | 185.220 g·mol−1 |
Heat of Formation | -472.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.57 ± 1.08 D |
Volume | 227.86 Å 3 |
Surface Area | 203.44 Å 2 |
HOMO Energy | -9.20 ± 0.55 eV |
LUMO Energy | 0.22 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | GRAGROPQORVALZ-VKWJFSHESA-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 |