(4As,7As)-1,4-Bis[3-(Hydroxymethyl)Benzyl]Hexahydro-1H-Pyrrolo[3,4-B]Pyrazine-2,3-Dione
Properties
Property | Value |
---|---|
Formula | C22H25N3O4 |
IUPAC Name | (4as,7as)-1,4-bis[[3-(hydroxymethyl)phenyl]methyl]-5,6,7,7a-tetrahydro-4ah-pyrrolo[3,4-b]pyrazine-2,3-dione |
Molecular Mass | 395.452 g·mol−1 |
Heat of Formation | -435.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.85 ± 1.08 D |
Volume | 469.25 Å 3 |
Surface Area | 392.6 Å 2 |
HOMO Energy | -9.59 ± 0.55 eV |
LUMO Energy | 2.70 ± eV |
Point Group Symmetry | C1 |
InChIKey | BNGHHYKOKSEZPO-PMACEKPBSA-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 |