2-{6-[4-(4-Benzyl-1-Phthalazinyl)-1-Piperazinyl]-3-Pyridinyl}-2-Propanol
Properties
Property | Value |
---|---|
Formula | C27H29N5O |
IUPAC Name | 2-[6-[4-(4-benzylphthalazin-1-yl)piperazin-1-yl]-3-pyridyl]propan-2-ol |
Molecular Mass | 439.552 g·mol−1 |
Heat of Formation | 277.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.04 ± 1.08 D |
Volume | 537.76 Å 3 |
Surface Area | 457.54 Å 2 |
HOMO Energy | -8.37 ± 0.55 eV |
LUMO Energy | 1.99 ± eV |
Point Group Symmetry | C1 |
InChIKey | KSWYJUIFHPSZOL-UHFFFAOYSA-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 |