Geometry & MOs

Info

ID:	288217
PubChem CID:	104313669
Reduced:	BrN2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	304.05751
ΔH_f, kcal/mol:	13.35
Dipole, Da:	0.76
IP(EA), eV:	-8.25(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromopyridin-2-yl)-N-methyl-3-phenylpropan-1-amine

Drug info:

PubChemData

Smile

CNC(C1CCCCC1)C2=C(C=CC=N2)Br

DOS

IR

Vibrations