Geometry & MOs

Info

ID:	353154
PubChem CID:	127284334
Reduced:	ON2C9H11 (2)
Stoich.:	AB2C9D11 (2)
Weight, g/mol:	341.148789
ΔH_f, kcal/mol:	-4.26
Dipole, Da:	3.18
IP(EA), eV:	-9.26(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methylfuro[3,2-b]pyridin-2-yl)-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN2CCN(CC2)C(=O)C3CCC4=CC=CC=C34

DOS

IR

Vibrations