Geometry & MOs

Info

ID:	383815
PubChem CID:	134975755
Reduced:	LiNC9H10 (1)
Stoich.:	ABC9D10 (1)
Weight, g/mol:	165.079964
ΔH_f, kcal/mol:	53.79
Dipole, Da:	7.03
IP(EA), eV:	-6.93(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;S-[(E)-but-2-enyl] N,N-dimethylcarbamothioate

Drug info:

PubChemData

Smile

[Li+].CN(C=[CH-])C1=CC=CC=C1

DOS

IR

Vibrations