Geometry & MOs

Info

ID:	442085
PubChem CID:	135249536
Reduced:	ON6C25H26 (1)
Stoich.:	AB6C25D26 (1)
Weight, g/mol:	383.17461
ΔH_f, kcal/mol:	66.11
Dipole, Da:	8.11
IP(EA), eV:	-8.08(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohexane-1-carbonitrile

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2=CC=C(C=C2)C3=CN=C4C(=C3N5CCC6(CCNC6=O)CC5)C=CN4

DOS

IR

Vibrations