4-(3-{4-[Cyclopentyl(3-Fluorophenyl)Hydroxymethyl]-1-Piperidinyl}Propoxy)Benzonitrile
Properties
Property | Value |
---|---|
Formula | C27H33FN2O2 |
IUPAC Name | 4-[3-[4-[(r)-cyclopentyl-(3-fluorophenyl)-hydroxy-methyl]-1-piperidyl]propoxy]benzonitrile |
Molecular Mass | 436.562 g·mol−1 |
Heat of Formation | -337.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.29 ± 1.08 D |
Volume | 547.16 Å 3 |
Surface Area | 467.91 Å 2 |
HOMO Energy | -9.16 ± 0.55 eV |
LUMO Energy | 2.42 ± eV |
Point Group Symmetry | C1 |
InChIKey | FTSMDZBUBLYVKI-HHHXNRCGSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O F |