(20R)-23-Amino-17-Fluoro-12,20-Dimethyl-13-Oxo-21-Oxa-3,9,12,24,26-Pentaazapentacyclo[20.3.1.0~2,10~.0~3,8~.0~14,19~]Hexacosa-1(26),2(10),4,6,8,14,16,18,22,24-Decaene-5-Carbonitrile
Properties
Property | Value |
---|---|
Formula | C23H18FN7O2 |
IUPAC Name | (20r)-23-amino-17-fluoro-12,20-dimethyl-13-oxo-21-oxa-3,9,12,24,26-pentaazapentacyclo[20.3.1.0 2,10 .0 3,8 .0 14,19 ]hexacosa-1(26),2(10),4,6,8,14,16,18,22,24-decaene-5-carbonitrile |
Molecular Mass | 443.433 g·mol−1 |
Heat of Formation | 116.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.67 ± 1.08 D |
Volume | 491.47 Å 3 |
Surface Area | 400.85 Å 2 |
HOMO Energy | -8.69 ± 0.55 eV |
LUMO Energy | 1.48 ± eV |
Point Group Symmetry | C1 |
InChIKey | MOENETCLMCOREY-GFCCVEGCSA-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 |