Geometry & MOs

Info

ID:	383505
PubChem CID:	134975261
Reduced:	NS2O5C20H23 (1)
Stoich.:	AB2C5D20E23 (1)
Weight, g/mol:	562.271924
ΔH_f, kcal/mol:	-129.59
Dipole, Da:	2.08
IP(EA), eV:	-9.07(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3,4,5-tris(phenylmethoxy)-2-(phenylmethoxymethyl)-6-prop-2-enylideneoxane

Drug info:

PubChemData

Smile

CC1(OC2[C@H]([C@H](OC2O1)C(=O)C(=C(SC)SC)C#N)OCC3=CC=CC=C3)C

DOS

IR

Vibrations