Geometry & MOs
Info
ID: |
133793 |
PubChem CID: |
51589621 |
Reduced: |
ClFN2O4C22H24 (1) |
Stoich.: |
ABC2D4E22F24 (1) |
Weight, g/mol: |
367.249787 |
ΔHf, kcal/mol: |
-207.87 |
Dipole, Da: |
4.91 |
IP(EA), eV: |
-9.2(-0.62) |
Spin(Sz, S2): |
None, None |
Charge, e: |
1 |
Chem-info
IUPAC name:
1-[(5S)-12-methyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraen-4-yl]-2-(4-methylpiperazin-4-ium-1-yl)ethanone