Geometry & MOs

Info

ID:	393578
PubChem CID:	135021078
Reduced:	NO3C7H9 (1)
Stoich.:	AB3C7D9 (1)
Weight, g/mol:	342.173213
ΔH_f, kcal/mol:	-102.42
Dipole, Da:	5.01
IP(EA), eV:	-10.28(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5S)-3-naphthalen-1-yl-4-phenyl-5-pyrrolidin-1-yl-4,5-dihydro-1,2-oxazole

Drug info:

PubChemData

Smile

C=C[C@@H]1[C@H]2[C@@H](CO1)NC(=O)O2

DOS

IR

Vibrations