Geometry & MOs

Info

ID:	406281
PubChem CID:	135077119
Reduced:	FO3H9C13 (1)
Stoich.:	AB3C9D13 (1)
Weight, g/mol:	265.06697
ΔH_f, kcal/mol:	-117.11
Dipole, Da:	6.3
IP(EA), eV:	-9.94(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(3-fluorophenyl)-5-methoxy-4-methylaniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC2=C(C=CC(=C2)F)C(=O)O

DOS

IR

Vibrations