Geometry & MOs

Info

ID:	353010
PubChem CID:	127284131
Reduced:	N2O3C20H26 (1)
Stoich.:	A2B3C20D26 (1)
Weight, g/mol:	336.158626
ΔH_f, kcal/mol:	-137.11
Dipole, Da:	2.65
IP(EA), eV:	-9.1(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1C(=O)NC2=CC=CC(=C2O1)C(=O)NC3CCC4CCCCC4C3

DOS

IR

Vibrations