Geometry & MOs

Info

ID:	9042
PubChem CID:	85555
Reduced:	N2O3H10C17 (1)
Stoich.:	A2B3C10D17 (1)
Weight, g/mol:	290.069142
ΔH_f, kcal/mol:	-6.05
Dipole, Da:	3.05
IP(EA), eV:	-8.96(-1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1,3-benzoxazol-2-yl)phenyl]pyrrole-2,5-dione

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)N4C(=O)C=CC4=O

DOS

IR

Vibrations