Geometry & MOs

Info

ID:	363320
PubChem CID:	127310832
Reduced:	ON5C16H19 (1)
Stoich.:	AB5C16D19 (1)
Weight, g/mol:	342.12628
ΔH_f, kcal/mol:	44.17
Dipole, Da:	5.26
IP(EA), eV:	-9.09(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1H-imidazol-2-yl)piperidin-1-yl]-[2-(1-methylpyrazol-4-yl)-1,3-thiazol-5-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=NC=CN2)C(=O)C3=NC(=NC=C3)C4CC4

DOS

IR

Vibrations