(2R)-1-[(4-Tert-Butylphenyl)Sulfonyl]-2-Methyl-4-(4-Nitrophenyl)Piperazine
Properties
Property | Value |
---|---|
Formula | C21H27N3O4S |
IUPAC Name | (1r,2r,4r)-1-(4-tert-butylphenyl)sulfonyl-2-methyl-4-(4-nitrophenyl)piperazine |
Molecular Mass | 417.522 g·mol−1 |
Heat of Formation | -267.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.78 ± 1.08 D |
Volume | 493.01 Å 3 |
Surface Area | 405.38 Å 2 |
HOMO Energy | -8.73 ± 0.55 eV |
LUMO Energy | -1.16 ± eV |
Point Group Symmetry | C1 |
InChIKey | SOFGQQQVQZQJFS-MRXNPFEDSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S O N |