Geometry & MOs

Info

ID:	193409
PubChem CID:	78391544
Reduced:	SiO5C27H34 (1)
Stoich.:	AB5C27D34 (1)
Weight, g/mol:	290.115424
ΔH_f, kcal/mol:	-202.96
Dipole, Da:	3.53
IP(EA), eV:	-9.0(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2,2-dimethyl-1,3-dioxolan-4-yl)-4-hydroxybut-2-ynyl] benzoate

Drug info:

PubChemData

Smile

CC(=O)OC(C#CCO[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C(C)(C)C)C3COC(O3)(C)C

DOS

IR

Vibrations