Geometry & MOs

Info

ID:	339784
PubChem CID:	127261793
Reduced:	NOSC11H13 (1)
Stoich.:	ABCD11E13 (1)
Weight, g/mol:	207.071785
ΔH_f, kcal/mol:	22.8
Dipole, Da:	2.59
IP(EA), eV:	-8.85(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5R)-4-methyl-5-methylsulfanyl-3-phenyl-4,5-dihydro-1,2-oxazole

Drug info:

PubChemData

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C[C@@H]1[C@@H](ON=C1C2=CC=CC=C2)SC

DOS

IR

Vibrations