Geometry & MOs

Info

ID:	362057
PubChem CID:	127305594
Reduced:	O2N3C18H21 (1)
Stoich.:	A2B3C18D21 (1)
Weight, g/mol:	326.174276
ΔH_f, kcal/mol:	-50.69
Dipole, Da:	5.48
IP(EA), eV:	-9.07(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[2.2.2]octan-3-yl)-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

CN(C1CN2CCC1CC2)C(=O)C3=CC4=CC=CC=C4C(=O)N3

DOS

IR

Vibrations