Geometry & MOs
Info
ID: |
409009 |
PubChem CID: |
135081782 |
Reduced: |
S5H6C9 (1) |
Stoich.: |
A5B6C9 (1) |
Weight, g/mol: |
631.353383 |
ΔHf, kcal/mol: |
63.01 |
Dipole, Da: |
2.99 |
IP(EA), eV: |
-8.38(-1.83) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2S)-1-[(2R,3R,4S)-4-benzyl-3-fluoro-2-hydroxy-5-[[(2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-5-oxopentyl]-N-tert-butyl-4-(pyridin-3-ylmethyl)piperazine-2-carboxamide