Geometry & MOs

Info

ID:	394651
PubChem CID:	135023404
Reduced:	SiO3C27H32 (1)
Stoich.:	AB3C27D32 (1)
Weight, g/mol:	340.203845
ΔH_f, kcal/mol:	-125.96
Dipole, Da:	2.2
IP(EA), eV:	-9.07(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methyl-4-phenylmethoxybutyl) 2,4,6-trimethylbenzoate

Drug info:

PubChemData

Smile

C[C@H]1[C@H](C(O[C@H]1C2=CC=CC=C2)O)O[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C

DOS

IR

Vibrations