Geometry & MOs

Info

ID:	386618
PubChem CID:	134982367
Reduced:	OSiC33H58 (1)
Stoich.:	ABC33D58 (1)
Weight, g/mol:	328.089817
ΔH_f, kcal/mol:	-163.85
Dipole, Da:	1.31
IP(EA), eV:	-8.29(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1E,3E)-4-diethoxyphosphorylbuta-1,3-dienyl]sulfinyl-4-methylbenzene

Drug info:

PubChemData

Smile

C[C@H]\1CC[C@@H](C/C1=C\C=C\2/CCCC3[C@H]2CC[C@@H]3[C@H](C)/C=C/[C@H](C)C(C)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations