Geometry & MOs

Info

ID:	423885
PubChem CID:	135120624
Reduced:	ON4C20H26 (1)
Stoich.:	AB4C20D26 (1)
Weight, g/mol:	296.138559
ΔH_f, kcal/mol:	9.29
Dipole, Da:	2.27
IP(EA), eV:	-8.54(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]-1-pyrimidin-4-ylethanamine

Drug info:

PubChemData

Smile

CN(C)C1=NC=C2CCC3(C2=N1)CCCN(C3)CC4=CC(=CC=C4)O

DOS

IR

Vibrations