14-Amino-20,21,22-Triazapentacyclo[Blah.Blah.Blah.Blah.Blah.Blah]Henicosa-1,3(9),4(11),5,10(12),13,15(21),16(20),17(22)-Nonaen-18-One
Properties
Property | Value |
---|---|
Formula | C18H12N4O |
IUPAC Name | 14-amino-20,21,22-triazapentacyclo[blah.blah.blah.blah.blah.blah]henicosa-1,3(9),4(11),5,10(12),13,15(21),16(20),17(22)-nonaen-18-one |
Molecular Mass | 300.314 g·mol−1 |
Heat of Formation | 284.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.32 ± 1.08 D |
Volume | 324.55 Å 3 |
Surface Area | 291.17 Å 2 |
HOMO Energy | -8.86 ± 0.55 eV |
LUMO Energy | 1.19 ± eV |
Point Group Symmetry | C1 |
InChIKey | XKMWVBVOQZNCOM-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |