Geometry & MOs

Info

ID:	401151
PubChem CID:	135050346
Reduced:	IN2O2C20H23 (1)
Stoich.:	AB2C2D20E23 (1)
Weight, g/mol:	160.053415
ΔH_f, kcal/mol:	1.95
Dipole, Da:	13.26
IP(EA), eV:	-7.7(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;methylsulfinylmethylbenzene

Drug info:

PubChemData

Smile

C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC=CC=C3)OC)O)CC#N.[I-]

DOS

IR

Vibrations