Geometry & MOs

Info

ID:	430387
PubChem CID:	135170451
Reduced:	NO2C11H17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	187.099714
ΔH_f, kcal/mol:	-30.62
Dipole, Da:	3.67
IP(EA), eV:	-9.83(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C(C)(C)COCC=C

DOS

IR

Vibrations