Geometry & MOs

Info

ID:	393148
PubChem CID:	135019558
Reduced:	O2H5N5C7 (1)
Stoich.:	A2B5C5D7 (1)
Weight, g/mol:	399.215806
ΔH_f, kcal/mol:	110.45
Dipole, Da:	5.68
IP(EA), eV:	-10.13(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,5S)-5-benzyl-3-methyl-3-(5-morpholin-4-yl-4-propan-2-yl-1,3-oxazol-2-yl)morpholin-2-one

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)[N+](=O)[O-])N2N=CC=N2

DOS

IR

Vibrations