Geometry & MOs

Info

ID:	282972
PubChem CID:	103949314
Reduced:	ClFNOC10H11 (1)
Stoich.:	ABCDE10F11 (1)
Weight, g/mol:	312.99138
ΔH_f, kcal/mol:	-65.63
Dipole, Da:	3.53
IP(EA), eV:	-8.94(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-bromo-4-fluoroanilino)methyl]-4-fluorophenol

Drug info:

PubChemData

Smile

C=C(CNCC1=C(C=CC(=C1)F)O)Cl

DOS

IR

Vibrations