Geometry & MOs

Info

ID:	294158
PubChem CID:	117428881
Reduced:	ON2C7H7 (2)
Stoich.:	AB2C7D7 (2)
Weight, g/mol:	270.111676
ΔH_f, kcal/mol:	8.68
Dipole, Da:	9.28
IP(EA), eV:	-8.78(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(3-amino-1,2-oxazol-5-yl)phenyl]-1,4-dimethylimidazol-2-one

Drug info:

PubChemData

Smile

CC1=NN(C2=C1C=C(C=C2)C3=CC(=NN3C)C(=O)O)C

DOS

IR

Vibrations