Geometry & MOs

Info

ID:	30739
PubChem CID:	841785
Reduced:	O2N3C11H15 (1)
Stoich.:	A2B3C11D15 (1)
Weight, g/mol:	221.116427
ΔH_f, kcal/mol:	-47.68
Dipole, Da:	3.33
IP(EA), eV:	-9.43(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,6S)-2,6-dimethylmorpholin-4-yl]-pyrazin-2-ylmethanone

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@H](O1)C)C(=O)C2=NC=CN=C2

DOS

IR

Vibrations