Geometry & MOs

Info

ID:	288178
PubChem CID:	104312685
Reduced:	FBr2N2H13C14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	320.05243
ΔH_f, kcal/mol:	12.42
Dipole, Da:	4.02
IP(EA), eV:	-9.44(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromopyridin-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine

Drug info:

PubChemData

Smile

CNC(CC1=CC(=C(C=C1)F)Br)C2=NC=C(C=C2)Br

DOS

IR

Vibrations