Geometry & MOs

Info

ID:	402491
PubChem CID:	135056181
Reduced:	FN2S2O3C30H39 (1)
Stoich.:	AB2C2D3E30F39 (1)
Weight, g/mol:	399.215806
ΔH_f, kcal/mol:	-103.21
Dipole, Da:	6.37
IP(EA), eV:	-8.54(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)[C@@H]([C@H](C(F)S(=O)(=O)C1=CC=CC=C1)N[S@](=O)C(C)(C)C)N(CC2=CC=CC=C2)CC3=CC=CC=C3

DOS

IR

Vibrations