Geometry & MOs

Info

ID:	20331
PubChem CID:	583156
Reduced:	NO2C11H11 (1)
Stoich.:	AB2C11D11 (1)
Weight, g/mol:	189.078979
ΔH_f, kcal/mol:	-15.69
Dipole, Da:	5.62
IP(EA), eV:	-9.66(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-dimethyl-3-phenyl-1,2-oxazol-5-one

Drug info:

PubChemData

Smile

CC1(C(=NOC1=O)C2=CC=CC=C2)C

DOS

IR

Vibrations