Geometry & MOs

Info

ID:	413971
PubChem CID:	135086923
Reduced:	SO2C14H20 (1)
Stoich.:	AB2C14D20 (1)
Weight, g/mol:	302.097666
ΔH_f, kcal/mol:	-78.63
Dipole, Da:	6.84
IP(EA), eV:	-9.24(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E)-1-benzylsulfonylprop-1-en-2-yl]-4-methoxybenzene

Drug info:

PubChemData

Smile

CCCC/C(=C/S(=O)(=O)CC1=CC=CC=C1)/C

DOS

IR

Vibrations