Geometry & MOs

Info

ID:	291648
PubChem CID:	113455769
Reduced:	BrClNC15H21 (1)
Stoich.:	ABCD15E21 (1)
Weight, g/mol:	304.05751
ΔH_f, kcal/mol:	-21.77
Dipole, Da:	3.97
IP(EA), eV:	-9.86(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-bromopyridin-2-yl)-N-methyl-2-phenylpropan-1-amine

Drug info:

PubChemData

Smile

CCCC1CCC(C(C1)CC2=CC(=CN=C2)Br)Cl

DOS

IR

Vibrations