4-(7-Chloro-2-Methoxy-Benzo[B][1,5]Naphthyridine-1,5-Diium-10-Yl)Imino-2,6-Bis(Pyrrolidin-1-Ylmethyl)Cyclohexa-2,5-Dien-1-One
Properties
Property | Value |
---|---|
Formula | C29H32ClN5O2++ |
IUPAC Name | 4-(7-chloro-2-methoxy-benzo[b][1,5]naphthyridine-1,5-diium-10-yl)imino-2,6-bis(pyrrolidin-1-ylmethyl)cyclohexa-2,5-dien-1-one |
Molecular Mass | 518.050 g·mol−1 |
Heat of Formation | 138.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.06 ± 1.08 D |
Volume | 633.28 Å 3 |
Surface Area | 493.2 Å 2 |
HOMO Energy | -7.21 ± 0.55 eV |
LUMO Energy | -1.29 ± eV |
Point Group Symmetry | C1 |
InChIKey | WYELHBYYXQXVGV-UHFFFAOYSA-P |
QR Code | Generate QR Code |
Links | PubChem |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O Cl |