Geometry & MOs

Info

ID:	442136
PubChem CID:	135250043
Reduced:	N2O2H32C47 (1)
Stoich.:	A2B2C32D47 (1)
Weight, g/mol:	408.195011
ΔH_f, kcal/mol:	129.11
Dipole, Da:	2.2
IP(EA), eV:	-8.5(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(3-phenylmethoxyphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile

Drug info:

PubChemData

Smile

C1COC(=N1)C2=CC=C(C=C2)C3=CC4=C(C=C3)C5=C(C=C4)C6=C(C57C8=CC=CC=C8C9=CC=CC=C79)C=C(C=C6)C1=CC=C(C=C1)C1=NCCO1

DOS

IR

Vibrations