Geometry & MOs

Info

ID:	266439
PubChem CID:	103566303
Reduced:	FNO5C10H10 (1)
Stoich.:	ABC5D10E10 (1)
Weight, g/mol:	265.085127
ΔH_f, kcal/mol:	-227.28
Dipole, Da:	6.21
IP(EA), eV:	-9.81(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-(3-cyano-5-methoxyphenoxy)benzonitrile

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)C(=O)N)OC(C(=O)O)F

DOS

IR

Vibrations