Geometry & MOs

Info

ID:	393186
PubChem CID:	135019642
Reduced:	SiO6C36H54 (1)
Stoich.:	AB6C36D54 (1)
Weight, g/mol:	444.214357
ΔH_f, kcal/mol:	-328.52
Dipole, Da:	3.24
IP(EA), eV:	-8.97(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-1-(1,3-benzodioxol-5-yl)-2,2-difluoro-3-hydroxy-5-tri(propan-2-yl)silyloxyhexan-1-one

Drug info:

PubChemData

Smile

CC1C[C@H]2C[C@@H]([C@H](C2(C(C1)OCOC)CCCO)CCCO[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)OC(=O)C

DOS

IR

Vibrations