Geometry & MOs

Info

ID:	396039
PubChem CID:	135027255
Reduced:	Si2O5C21H44 (1)
Stoich.:	A2B5C21D44 (1)
Weight, g/mol:	238.135765
ΔH_f, kcal/mol:	-360.11
Dipole, Da:	3.58
IP(EA), eV:	-8.87(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-4-(2-phenylbut-3-enyl)benzene

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)O[C@@H]1[C@@H]([C@@H](C[C@@]1(C)OCOC)O[Si](C)(C)C(C)(C)C)C=O

DOS

IR

Vibrations