Geometry & MOs

Info

ID:	161221
PubChem CID:	57391076
Reduced:	O2F3N5C26H26 (1)
Stoich.:	A2B3C5D26E26 (1)
Weight, g/mol:	293.107674
ΔH_f, kcal/mol:	-135.08
Dipole, Da:	5.48
IP(EA), eV:	-9.39(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-fluorophenyl)methyl]-3-(1H-1,2,4-triazol-5-yl)imidazo[1,5-a]pyridine

Drug info:

PubChemData

Smile

C1CN(CCC12CC(C2)CC3=CC(=CC=C3)OC4=NC=C(C=C4)C(F)(F)F)C(=O)NC5=NN=CC=C5

DOS

IR

Vibrations