Geometry & MOs
Info
ID: |
320136 |
PubChem CID: |
126658441 |
Reduced: |
NC16H25 (1) |
Stoich.: |
AB16C25 (1) |
Weight, g/mol: |
788.341274 |
ΔHf, kcal/mol: |
75.4 |
Dipole, Da: |
2.8 |
IP(EA), eV: |
-8.18(0.17) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
3,5-diamino-6-chloro-N-[N'-[4-[4-[2-[[(2S,3E)-2,3-dihydroxy-3-[(5R)-5-hydroxy-2-phenyl-1,3-dioxan-4-ylidene]propyl]-(3-phenylpropyl)amino]ethoxy]phenyl]butyl]carbamimidoyl]pyrazine-2-carboxamide