Geometry & MOs

Info

ID:	394899
PubChem CID:	135024092
Reduced:	CdC3S5 (1)
Stoich.:	AB3C5 (1)
Weight, g/mol:	353.162708
ΔH_f, kcal/mol:	138.17
Dipole, Da:	0.54
IP(EA), eV:	-7.92(-2.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(12S,15S,16R,18R,19S)-21-hydroxy-15,19-dimethyl-4-oxa-14-azahexacyclo[14.4.1.02,7.08,20.012,19.014,18]henicosa-1(21),2(7),8(20)-triene-3,9-dione

Drug info:

PubChemData

Smile

C1(=C(SC(=S)S1)[S-])[S-].[Cd+2]

DOS

IR

Vibrations