N-[2-(Benzoylamino)-1,3-Benzothiazol-6-Yl]-1-Adamantanecarboxamide
Properties
Property | Value |
---|---|
Formula | C25H25N3O2S |
IUPAC Name | n-(2-benzamido-1,3-benzothiazol-6-yl)adamantane-1-carboxamide |
Molecular Mass | 431.550 g·mol−1 |
Heat of Formation | -99.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.33 ± 1.08 D |
Volume | 495.44 Å 3 |
Surface Area | 431.0 Å 2 |
HOMO Energy | -8.42 ± 0.55 eV |
LUMO Energy | -0.76 ± eV |
Point Group Symmetry | C1 |
InChIKey | MVSSJPGNLQPWSW-CIRRPZLZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |