Geometry & MOs

Info

ID:	143742
PubChem CID:	53253236
Reduced:	ON6C16H16 (1)
Stoich.:	AB6C16D16 (1)
Weight, g/mol:	332.174945
ΔH_f, kcal/mol:	78.19
Dipole, Da:	6.49
IP(EA), eV:	-9.11(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(cyclohexylmethylamino)pyrimidin-2-yl]imidazo[1,2-a]pyridine-6-carbonitrile

Drug info:

PubChemData

Smile

C[C@@H](COC)NC1=NC(=NC=C1)C2=CN=C3N2C=C(C=C3)C#N

DOS

IR

Vibrations