Geometry & MOs

Info

ID:	288168
PubChem CID:	104312421
Reduced:	BrN2C11H17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	290.04186
ΔH_f, kcal/mol:	6.6
Dipole, Da:	2.05
IP(EA), eV:	-9.59(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromopyridin-2-yl)-2-(3-methylphenyl)ethanamine

Drug info:

PubChemData

Smile

CCC(C)CC(C1=NC=C(C=C1)Br)N

DOS

IR

Vibrations