Geometry & MOs

Info

ID:	403002
PubChem CID:	135058252
Reduced:	OSiC17H26 (1)
Stoich.:	ABC17D26 (1)
Weight, g/mol:	297.045964
ΔH_f, kcal/mol:	-55.07
Dipole, Da:	4.69
IP(EA), eV:	-9.46(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenyl)sulfinyl-1-benzofuran-3-carbonitrile

Drug info:

PubChemData

Smile

CCCCCC/C(=C/C=O)/[Si](C)(C)C1=CC=CC=C1

DOS

IR

Vibrations