Geometry & MOs

Info

ID:	60789
PubChem CID:	26702184
Reduced:	N2O5C19H20 (1)
Stoich.:	A2B5C19D20 (1)
Weight, g/mol:	443.01685
ΔH_f, kcal/mol:	-159.28
Dipole, Da:	1.37
IP(EA), eV:	-8.42(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2-bromobenzoyl)amino]phenyl] 3-fluoro-4-methoxybenzoate

Drug info:

PubChemData

Smile

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=CC3=C(C=C2)NC(=O)CO3

DOS

IR

Vibrations