Geometry & MOs

Info

ID:	224432
PubChem CID:	85342815
Reduced:	SiO4C26H42 (1)
Stoich.:	AB4C26D42 (1)
Weight, g/mol:	450.124943
ΔH_f, kcal/mol:	-239.74
Dipole, Da:	0.9
IP(EA), eV:	-8.78(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-diphenyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1(CCC(C=C1)C(=O)OC)C(CCCOCC2=CC=CC=C2)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations