Geometry & MOs
Info
ID: |
299573 |
PubChem CID: |
117687903 |
Reduced: |
OC14H24 (1) |
Stoich.: |
AB14C24 (1) |
Weight, g/mol: |
674.313806 |
ΔHf, kcal/mol: |
-78.06 |
Dipole, Da: |
1.67 |
IP(EA), eV: |
-9.32(1.31) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(1R,2S)-1-[[(3R,5S,8S)-8-butyl-7,10,10-trioxo-21-phenyl-2-oxa-10lambda6-thia-6,9,20-triazatetracyclo[14.6.2.13,6.019,23]pentacosa-1(22),16(24),17,19(23),20-pentaen-5-yl]methylamino]-2-ethenylcyclopropane-1-carboxylic acid