Geometry & MOs

Info

ID:	200556
PubChem CID:	79410521
Reduced:	N2O3C12H24 (1)
Stoich.:	A2B3C12D24 (1)
Weight, g/mol:	261.111341
ΔH_f, kcal/mol:	-166.65
Dipole, Da:	5.38
IP(EA), eV:	-9.36(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methyl]-1H-quinoxalin-2-one

Drug info:

PubChemData

Smile

CC(C)N(C(C)C)C(=O)CN1C[C@H]([C@H](C1)O)O

DOS

IR

Vibrations