Geometry & MOs

Info

ID:	362023
PubChem CID:	127305552
Reduced:	O2N5C19H21 (1)
Stoich.:	A2B5C19D21 (1)
Weight, g/mol:	292.153541
ΔH_f, kcal/mol:	12.65
Dipole, Da:	6.81
IP(EA), eV:	-8.82(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[2.2.2]octan-3-yl)-N,1-dimethyl-2,4-dioxopyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CN(C1CN2CCC1CC2)C(=O)C3=CNN4C3=NC(=O)C5=CC=CC=C54

DOS

IR

Vibrations