Geometry & MOs

Info

ID:	288188
PubChem CID:	104313288
Reduced:	BrON2C15H17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	306.03678
ΔH_f, kcal/mol:	4.01
Dipole, Da:	3.61
IP(EA), eV:	-8.38(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromopyridin-2-yl)-2-(3-methoxyphenyl)ethanamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)CC(C2=C(C=CC=N2)Br)N

DOS

IR

Vibrations