Geometry & MOs

Info

ID:	344477
PubChem CID:	127268061
Reduced:	FO3N4C20H25 (1)
Stoich.:	AB3C4D20E25 (1)
Weight, g/mol:	383.19574
ΔH_f, kcal/mol:	-97.36
Dipole, Da:	3.4
IP(EA), eV:	-9.33(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-dimethyl-4-[2-[[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]amino]acetyl]-1H-quinoxalin-2-one

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C2(CCCC2)NCC(=O)N3CCOC(C3)C4=CC=C(C=C4)F

DOS

IR

Vibrations