Geometry & MOs

Info

ID:	330297
PubChem CID:	127247284
Reduced:	ON6C17H18 (1)
Stoich.:	AB6C17D18 (1)
Weight, g/mol:	322.154209
ΔH_f, kcal/mol:	75.97
Dipole, Da:	6.06
IP(EA), eV:	-9.58(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-imidazol-1-ylpyridin-3-yl)-[2-(1H-pyrazol-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CC=NN2)C(=O)C3=CN=C(C=C3)N4C=CC=N4

DOS

IR

Vibrations