Geometry & MOs

Info

ID:	381123
PubChem CID:	134971771
Reduced:	NOLi2C9H9 (1)
Stoich.:	ABC2D9E9 (1)
Weight, g/mol:	220.128572
ΔH_f, kcal/mol:	-58.26
Dipole, Da:	6.22
IP(EA), eV:	-7.28(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl-methylidene-[(E,2R)-2-phenylhex-3-en-3-yl]-lambda4-sulfane

Drug info:

PubChemData

Smile

[Li+].[Li+].C/C=C(\[N-]C1=CC=CC=C1)/[O-]

DOS

IR

Vibrations