Geometry & MOs

Info

ID:	145144
PubChem CID:	53469686
Reduced:	N3H13C20 (1)
Stoich.:	A3B13C20 (1)
Weight, g/mol:	325.121512
ΔH_f, kcal/mol:	168.99
Dipole, Da:	2.76
IP(EA), eV:	-8.17(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-methoxyphenyl)ethynyl]-3-pyridin-2-ylimidazo[1,5-a]pyridine

Drug info:

PubChemData

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C1=CC=C(C=C1)C#CC2=C3C=CC=CN3C(=N2)C4=CC=CC=N4

DOS

IR

Vibrations