(3E)-N-Methyl-3-(5-Oxidodibenzo[B,E]Thiepin-11(6H)-Ylidene)-1-Propanamine
Properties
Property | Value |
---|---|
Formula | C18H19NOS |
IUPAC Name | (3z)-n-methyl-3-[(5s)-5-oxo-6h-benzo[c][1]benzothiepin-11-ylidene]propan-1-amine |
Molecular Mass | 297.415 g·mol−1 |
Heat of Formation | 122.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.49 ± 1.08 D |
Volume | 362.96 Å 3 |
Surface Area | 317.16 Å 2 |
HOMO Energy | -8.56 ± 0.55 eV |
LUMO Energy | -0.34 ± eV |
Point Group Symmetry | C1 |
InChIKey | XBXURVRTJAZSCN-IXMGXUHHSA-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 |