Geometry & MOs

Info

ID:	125241
PubChem CID:	50916573
Reduced:	NSiO3C24H39 (1)
Stoich.:	ABC3D24E39 (1)
Weight, g/mol:	326.137422
ΔH_f, kcal/mol:	-210.42
Dipole, Da:	5.61
IP(EA), eV:	-8.82(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-2-(2,2-diethoxyethyl)-1,3-dithiane

Drug info:

PubChemData

Smile

CC(C)C[C@H]1C[C@@H](C(=O)N1)[C@@H](CC(=O)CC2=CC=CC=C2)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations