Tert-Butyl N-(4-Chlorobenzyl)-N-[(5-Nitro-2-Thienyl)Methyl]Glycinate
Properties
Property | Value |
---|---|
Formula | C18H21ClN2O4S |
IUPAC Name | tert-butyl 2-[(4-chlorophenyl)methyl-[(5-nitro-2-thienyl)methyl]amino]acetate |
Molecular Mass | 396.888 g·mol−1 |
Heat of Formation | -294.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.26 ± 1.08 D |
Volume | 459.81 Å 3 |
Surface Area | 371.11 Å 2 |
HOMO Energy | -9.53 ± 0.55 eV |
LUMO Energy | 1.58 ± eV |
Point Group Symmetry | C1 |
InChIKey | WYSLOKHVFKLWOU-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C Cl H O N S |