Geometry & MOs

Info

ID:	262582
PubChem CID:	103302350
Reduced:	BrNF3H13C15 (1)
Stoich.:	ABC3D13E15 (1)
Weight, g/mol:	285.053211
ΔH_f, kcal/mol:	-96.43
Dipole, Da:	3.95
IP(EA), eV:	-9.47(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-N-methyl-1-(2,4,5-trifluorophenyl)methanamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(C2=CC(=C(C=C2F)F)F)NC)Br

DOS

IR

Vibrations