Geometry & MOs

Info

ID:

375958

PubChem CID:

134221955

Reduced:

PO17C94H101 (1)

Stoich.:

AB17C94D101 (1)

Weight, g/mol:

381.210407

ΔHf, kcal/mol:

-519.31

Dipole, Da:

4.33

IP(EA), eV:

 -8.24(0.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[4-(8-fluoro-5-methyl-3,4-dihydro-2H-chromen-6-yl)-1,2,2,6-tetramethyl-3H-indol-5-yl]acetaldehyde

Drug info:

PubChemData

Smile

C1[C@H](C(OC1OCC(C(C(COP(OCC2=CC=CC=C2)O[C@@H]3CC(OC3COCC4=CC=CC=C4)OCC(C(C(COCC5=CC6=CC=CC=C6C=C5)OCC7=CC=CC=C7)OCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)COCC1=CC=CC=C1)O

DOS

IR

Vibrations