Geometry & MOs

Info

ID:	332290
PubChem CID:	127250576
Reduced:	SO3N6C19H22 (1)
Stoich.:	AB3C6D19E22 (1)
Weight, g/mol:	403.144453
ΔH_f, kcal/mol:	-16.7
Dipole, Da:	8.15
IP(EA), eV:	-9.26(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[6-(3-fluorophenyl)pyridin-2-yl]morpholin-4-yl]-imidazo[1,2-a]pyrimidin-2-ylmethanone

Drug info:

PubChemData

Smile

CCN1C=C(C(=N1)C)S(=O)(=O)N2CCOC(C2)C3=CC=CC(=N3)C4=CN=CN=C4

DOS

IR

Vibrations