Geometry & MOs

Info

ID:	430566
PubChem CID:	135170632
Reduced:	ClN3C13H16 (1)
Stoich.:	AB3C13D16 (1)
Weight, g/mol:	151.099714
ΔH_f, kcal/mol:	37.46
Dipole, Da:	1.92
IP(EA), eV:	-9.33(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-ethylcyclopropyl)-5-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=NN(C(=N1)C(C)(C)C)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations