Geometry & MOs

Info

ID:	339785
PubChem CID:	127261794
Reduced:	NOSC11H13 (1)
Stoich.:	ABCD11E13 (1)
Weight, g/mol:	237.115364
ΔH_f, kcal/mol:	21.69
Dipole, Da:	2.3
IP(EA), eV:	-8.89(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations