Geometry & MOs

Info

ID:	364783
PubChem CID:	127316121
Reduced:	O2N5C19H25 (1)
Stoich.:	A2B5C19D25 (1)
Weight, g/mol:	352.164774
ΔH_f, kcal/mol:	-15.09
Dipole, Da:	5.09
IP(EA), eV:	-8.21(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(1H-imidazol-2-ylmethyl)piperazine-1-carbonyl]-8-methylpyrido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=NC=CN2)C(=O)C3=CC=CC=C3N4CCOCC4

DOS

IR

Vibrations