Geometry & MOs

Info

ID:	240804
PubChem CID:	93617640
Reduced:	SN2O3C15H18 (1)
Stoich.:	AB2C3D15E18 (1)
Weight, g/mol:	306.103814
ΔH_f, kcal/mol:	-79.76
Dipole, Da:	3.43
IP(EA), eV:	-9.07(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,6S)-2,6-dimethylmorpholin-4-yl]-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methanone

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@H](O1)C)C(=O)C2=C(OC(=N2)C3=CC=CS3)C

DOS

IR

Vibrations