Geometry & MOs

Info

ID:	345796
PubChem CID:	127270096
Reduced:	SO2N4C19H22 (1)
Stoich.:	AB2C4D19E22 (1)
Weight, g/mol:	337.153875
ΔH_f, kcal/mol:	-33.74
Dipole, Da:	2.59
IP(EA), eV:	-8.86(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-imidazol-1-ylpiperidine-1-carbonyl)-7-methylpyrido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

C1CN(CCC1N2C=CN=C2)C(=O)CCN3C(=O)CSC4=CC=CC=C43

DOS

IR

Vibrations