(−)-Agelastatin A
Properties
Property | Value |
---|---|
Formula | C12H13BrN4O3 |
IUPAC Name | (−)-agelastatin a |
Molecular Mass | 341.161 g·mol−1 |
Heat of Formation | -342.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.79 ± 1.08 D |
Volume | 321.36 Å 3 |
Surface Area | 274.35 Å 2 |
HOMO Energy | -9.40 ± 0.55 eV |
LUMO Energy | -0.40 ± eV |
Point Group Symmetry | C1 |
CAS Number(s) |
|
InChIKey | MPASKXAEPUAMBS-WJOUQXRDSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O Br N |