Geometry & MOs

Info

ID:	433156
PubChem CID:	135173293
Reduced:	ON2C11H14 (1)
Stoich.:	AB2C11D14 (1)
Weight, g/mol:	360.0657
ΔH_f, kcal/mol:	-3.05
Dipole, Da:	3.34
IP(EA), eV:	-8.69(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-3-[(5-chloro-6-methylpyrazolo[4,3-b]pyridin-1-yl)methyl]-2,6-dimethylpyrazolo[4,3-b]pyridine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2CCC(=N2)N

DOS

IR

Vibrations