Geometry & MOs

Info

ID:

329223

PubChem CID:

126732554

Reduced:

SO2C19H38 (1)

Stoich.:

AB2C19D38 (1)

Weight, g/mol:

570.195521

ΔHf, kcal/mol:

-173.2

Dipole, Da:

2.99

IP(EA), eV:

-8.93(0.58)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3R,6R,7S,8E,11S,21S)-7'-chloro-7-hydroxy-11-methyl-12,12-dioxospiro[19-oxa-12lambda6-thia-1,13-diazatetracyclo[13.7.2.03,6.018,23]tetracosa-8,15(24),16,18(23)-tetraene-21,4'-2,3-dihydro-1H-naphthalene]-14-one

Drug info:

PubChemData

Smile

CCCCCCCCCC(CCCCCCCC(=O)OC)S

DOS

IR

Vibrations