Geometry & MOs

Info

ID:	333750
PubChem CID:	127252302
Reduced:	F3O3N5C21H22 (1)
Stoich.:	A3B3C5D21E22 (1)
Weight, g/mol:	381.216475
ΔH_f, kcal/mol:	-176.51
Dipole, Da:	2.35
IP(EA), eV:	-9.39(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[8-acetyl-1-(quinoxalin-6-ylmethyl)-1,8-diazaspiro[4.5]decan-3-yl]acetamide

Drug info:

PubChemData

Smile

CN1C(=CC(=N1)C2CN(CCO2)C(=O)C3=CC=NN3)CCOC4=CC=CC(=C4)C(F)(F)F

DOS

IR

Vibrations