Geometry & MOs

Info

ID:	372484
PubChem CID:	131298432
Reduced:	FN2O3C9H11 (1)
Stoich.:	AB2C3D9E11 (1)
Weight, g/mol:	204.126263
ΔH_f, kcal/mol:	-86.84
Dipole, Da:	4.28
IP(EA), eV:	-9.56(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-tert-butyl-3,4-dihydro-1H-quinoxalin-2-one

Drug info:

PubChemData

Smile

CC(CC1=CC(=C(C(=C1)F)O)[N+](=O)[O-])N

DOS

IR

Vibrations