Geometry & MOs

Info

ID:	29442
PubChem CID:	833825
Reduced:	ON5C13H17 (1)
Stoich.:	AB5C13D17 (1)
Weight, g/mol:	327.125929
ΔH_f, kcal/mol:	37.78
Dipole, Da:	5.19
IP(EA), eV:	-9.57(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethylphenyl)-4-(naphthalen-2-ylmethylidene)-1,3-oxazol-5-one

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)CN1N=C(N=N1)C2=CC=CC=C2

DOS

IR

Vibrations