Geometry & MOs

Info

ID:	423182
PubChem CID:	135119058
Reduced:	ON5C16H23 (1)
Stoich.:	AB5C16D23 (1)
Weight, g/mol:	398.15902
ΔH_f, kcal/mol:	0.37
Dipole, Da:	7.17
IP(EA), eV:	-8.72(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carbonyl)-5,6,8,8a-tetrahydro-1H-[1,3]oxazolo[3,4-a]pyrazin-3-one

Drug info:

PubChemData

Smile

CCC1=CN=C(N=C1N2C[C@H]([C@@H](C2)O)CC3=NNC(=C3)C)C

DOS

IR

Vibrations