Geometry & MOs

Info

ID:	48019
PubChem CID:	10536556
Reduced:	NOSiC11H23 (1)
Stoich.:	ABCD11E23 (1)
Weight, g/mol:	214.156895
ΔH_f, kcal/mol:	-106.69
Dipole, Da:	3.32
IP(EA), eV:	-8.98(1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,5S)-5-[(4R)-2,2-dimethyl-1,3-dioxan-4-yl]hex-2-en-1-ol

Drug info:

PubChemData

Smile

C[C@H](CC#N)CO[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations