5-[(7-Methyl-1,4-Diazepan-1-Yl)Sulfonyl]Isoquinoline
Properties
Property | Value |
---|---|
Formula | C15H19N3O2S |
IUPAC Name | 5-[[(1s,7r)-7-methyl-1,4-diazepan-1-yl]sulfonyl]isoquinoline |
Molecular Mass | 305.395 g·mol−1 |
Heat of Formation | -135.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.98 ± 1.08 D |
Volume | 352.46 Å 3 |
Surface Area | 280.13 Å 2 |
HOMO Energy | -8.85 ± 0.55 eV |
LUMO Energy | -1.64 ± eV |
Point Group Symmetry | C1 |
InChIKey | OCLSLNOZIMMUIC-GFCCVEGCSA-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 |