Geometry & MOs

Info

ID:	288283
PubChem CID:	104314608
Reduced:	FBr2N2H13C14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	451.83576
ΔH_f, kcal/mol:	7.23
Dipole, Da:	2.67
IP(EA), eV:	-9.22(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-2-fluorophenyl)-1-(3,5-dibromopyridin-2-yl)-N-methylmethanamine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)F)C(C2=C(C=C(C=N2)Br)Br)NC

DOS

IR

Vibrations