Geometry & MOs

Info

ID:	220743
PubChem CID:	85230834
Reduced:	LiON2C13H21 (1)
Stoich.:	ABC2D13E21 (1)
Weight, g/mol:	228.056863
ΔH_f, kcal/mol:	89.65
Dipole, Da:	14.2
IP(EA), eV:	-5.87(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[1-(6-oxocyclohexa-2,4-dien-1-ylidene)ethyl]methanesulfonohydrazide

Drug info:

PubChemData

Smile

[Li+].CC1=[C-]C(=NN2CCCC2COC)CCC1

DOS

IR

Vibrations