Geometry & MOs

Info

ID:	221925
PubChem CID:	85292795
Reduced:	NSiO4C21H33 (1)
Stoich.:	ABC4D21E33 (1)
Weight, g/mol:	392.097215
ΔH_f, kcal/mol:	-224.46
Dipole, Da:	5.63
IP(EA), eV:	-9.19(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-3a,8-dimethyl-7-(2-sulfanylethylsulfanyl)spiro[1,3,4,5,6,7-hexahydroazulene-2,2'-1,3-dithiolane]-4-ol

Drug info:

PubChemData

Smile

CC(C)C(C1(C(=O)OC(=O)N1CC2=CC=CC=C2)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations