Geometry & MOs

Info

ID:	327925
PubChem CID:	126691393
Reduced:	ON7C23H25 (1)
Stoich.:	AB7C23D25 (1)
Weight, g/mol:	443.152829
ΔH_f, kcal/mol:	91.4
Dipole, Da:	4.1
IP(EA), eV:	-9.6(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methylimidazo[2,1-b][1,3,4]thiadiazol-6-yl)methyl]-1-[(2R)-2-methyloxan-4-yl]imidazo[4,5-c]quinoline-8-carbonitrile

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@H](CCO1)N2C(=NC3=CN=C4C=CC(=CC4=C32)C#N)CN5C=C(N=N5)C(C)C

DOS

IR

Vibrations