Geometry & MOs

Info

ID:	419447
PubChem CID:	135108193
Reduced:	FN6C11H15 (1)
Stoich.:	AB6C11D15 (1)
Weight, g/mol:	328.153541
ΔH_f, kcal/mol:	37.09
Dipole, Da:	5.27
IP(EA), eV:	-8.62(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(1S,5S)-7-methyl-3-oxa-7,9-diazabicyclo[3.3.2]decane-9-carbonyl]-1H-quinoxalin-2-one

Drug info:

PubChemData

Smile

CN(C)C1=NC(=NC=C1F)NCCC2=CNN=C2

DOS

IR

Vibrations