Geometry & MOs

Info

ID:	51781
PubChem CID:	12014520
Reduced:	NO4H19C23 (1)
Stoich.:	AB4C19D23 (1)
Weight, g/mol:	427.178358
ΔH_f, kcal/mol:	-45.36
Dipole, Da:	2.58
IP(EA), eV:	-9.02(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl 5-benzoyl-3-naphthalen-2-yl-4H-1,2-oxazole-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1(CC(=NO1)C2=CC3=CC=CC=C3C=C2)C(=O)C4=CC=CC=C4

DOS

IR

Vibrations