Geometry & MOs

Info

ID:	339788
PubChem CID:	127261797
Reduced:	NOSH15C16 (1)
Stoich.:	ABCD15E16 (1)
Weight, g/mol:	207.071785
ΔH_f, kcal/mol:	49.48
Dipole, Da:	1.67
IP(EA), eV:	-9.04(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

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C[C@@H]1[C@H](C(=NO1)C2=CC=CC=C2)SC3=CC=CC=C3

DOS

IR

Vibrations