Geometry & MOs

Info

ID:	187979
PubChem CID:	77649859
Reduced:	ClFO2H6C9 (1)
Stoich.:	ABC2D6E9 (1)
Weight, g/mol:	269.177964
ΔH_f, kcal/mol:	-101.24
Dipole, Da:	5.86
IP(EA), eV:	-10.04(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methoxyphenyl)-3-methyl-1-phenylbutan-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations