Geometry & MOs

Info

ID:	288211
PubChem CID:	104313540
Reduced:	BrN2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	344.0136
ΔH_f, kcal/mol:	5.38
Dipole, Da:	2.94
IP(EA), eV:	-9.49(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromopyridin-2-yl)-N-methyl-1-[2-(trifluoromethyl)phenyl]methanamine

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(C2=C(C=CC=N2)Br)N

DOS

IR

Vibrations