Geometry & MOs

Info

ID:	163708
PubChem CID:	58106749
Reduced:	NZrH10C13 (1)
Stoich.:	ABC10D13 (1)
Weight, g/mol:	224.05183
ΔH_f, kcal/mol:	200.64
Dipole, Da:	6.29
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.978082
Charge, e:	-1

Chem-info

IUPAC name:

2,3a,4,5-tetrahydro-1H-imidazo[1,2-a]quinolin-3-ide;vanadium

Drug info:

PubChemData

Smile

[CH]C1=NC(=CC=C1)CC2=CC=CC=[C-]2.[Zr]

DOS

IR

Vibrations