Geometry & MOs

Info

ID:	240943
PubChem CID:	93618337
Reduced:	SN2O4C9H16 (1)
Stoich.:	AB2C4D9E16 (1)
Weight, g/mol:	266.163043
ΔH_f, kcal/mol:	-175.07
Dipole, Da:	7.8
IP(EA), eV:	-9.29(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[2-[(1S,2R)-2-methylcyclohexyl]oxyethyl]-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](COC)NC(=O)N1CSC[C@H]1C(=O)O

DOS

IR

Vibrations