Geometry & MOs

Info

ID:	333939
PubChem CID:	127252491
Reduced:	FON2C21H25 (1)
Stoich.:	ABC2D21E25 (1)
Weight, g/mol:	338.174276
ΔH_f, kcal/mol:	-53.89
Dipole, Da:	2.83
IP(EA), eV:	-8.9(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyrazin-2-yl-[3-(pyridin-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decan-8-yl]methanone

Drug info:

PubChemData

Smile

C1CN(CCC12CC(CO2)CC3=CC=C(C=C3)F)CC4=CN=CC=C4

DOS

IR

Vibrations