Geometry & MOs

Info

ID:	406510
PubChem CID:	135077887
Reduced:	ClO2N3H8C13 (1)
Stoich.:	AB2C3D8E13 (1)
Weight, g/mol:	281.105193
ΔH_f, kcal/mol:	48.72
Dipole, Da:	4.49
IP(EA), eV:	-9.14(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-benzyl-2-(3-methoxyphenyl)-4H-1,3-oxazol-5-one

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)C2=C(ON=[N+]2C3=CC=C(C=C3)Cl)[O-]

DOS

IR

Vibrations