Geometry & MOs

Info

ID:	404868
PubChem CID:	135071538
Reduced:	SiO6C34H46 (1)
Stoich.:	AB6C34D46 (1)
Weight, g/mol:	286.102751
ΔH_f, kcal/mol:	-221.62
Dipole, Da:	5.39
IP(EA), eV:	-8.7(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-4-(benzenesulfonyl)pent-3-enyl]benzene

Drug info:

PubChemData

Smile

C/C=C\C=C\C1=C(C(=CC=C1)O[Si](C)(C)C(C)(C)C)C(=O)O[C@@H](CCOCC2=CC=C(C=C2)OC)C[C@H]3[C@H](O3)C=C

DOS

IR

Vibrations