Geometry & MOs

Info

ID:	411603
PubChem CID:	135084435
Reduced:	IO2C13H13 (1)
Stoich.:	AB2C13D13 (1)
Weight, g/mol:	244.149471
ΔH_f, kcal/mol:	-1.89
Dipole, Da:	1.69
IP(EA), eV:	-9.66(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]oxan-3-ol

Drug info:

PubChemData

Smile

C#CCCCCOC(=O)C1=CC=CC=C1I

DOS

IR

Vibrations