Geometry & MOs

Info

ID:	180372
PubChem CID:	76623352
Reduced:	YO2N3H20C23 (1)
Stoich.:	AB2C3D20E23 (1)
Weight, g/mol:	178.960595
ΔH_f, kcal/mol:	170.38
Dipole, Da:	20.38
IP(EA), eV:	-6.4(-2.26)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

chlorozinc(1+);cyclohexa-1,3-diene

Drug info:

PubChemData

Smile

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CN=C5C=[C-]C=CC5=C4.[Y]

DOS

IR

Vibrations