Geometry & MOs

Info

ID:	51779
PubChem CID:	12014518
Reduced:	NO3H19C27 (1)
Stoich.:	AB3C19D27 (1)
Weight, g/mol:	359.115758
ΔH_f, kcal/mol:	40.33
Dipole, Da:	2.58
IP(EA), eV:	-8.98(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1C(=NOC1(C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)C4=CC5=CC=CC=C5C=C4

DOS

IR

Vibrations