Geometry & MOs

Info

ID:	227719
PubChem CID:	87562298
Reduced:	O3H16C18 (1)
Stoich.:	A3B16C18 (1)
Weight, g/mol:	264.089878
ΔH_f, kcal/mol:	-46.19
Dipole, Da:	4.11
IP(EA), eV:	-8.63(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-formylphenyl)isoindole-2-carboxamide

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2OC1.C1=CC=C2C(=C1)C=CC(=O)O2

DOS

IR

Vibrations