Geometry & MOs

Info

ID:	339786
PubChem CID:	127261795
Reduced:	NOH15C16 (1)
Stoich.:	ABC15D16 (1)
Weight, g/mol:	282.100442
ΔH_f, kcal/mol:	45.17
Dipole, Da:	3.54
IP(EA), eV:	-8.99(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5R)-5-methyl-3-(4-nitrophenyl)-4-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)C3=CC=CC=C3

DOS

IR

Vibrations