Geometry & MOs

Info

ID:	202927
PubChem CID:	79747063
Reduced:	ClFC12H16 (1)
Stoich.:	ABC12D16 (1)
Weight, g/mol:	333.05284
ΔH_f, kcal/mol:	-72.76
Dipole, Da:	2.01
IP(EA), eV:	-9.45(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-4-fluorophenyl)-N-methyl-1-(1-phenylcyclopropyl)methanamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(C(C)(C)C)Cl)F

DOS

IR

Vibrations