Geometry & MOs

Info

ID:	27692
PubChem CID:	823112
Reduced:	SO3N5C11H13 (1)
Stoich.:	AB3C5D11E13 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-78.98
Dipole, Da:	1.6
IP(EA), eV:	-9.16(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2E)-2-[(3,4-dimethoxyphenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-ylidene]hydrazine

Drug info:

PubChemData

Smile

CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC(=O)N)CC=C

DOS

IR

Vibrations