Geometry & MOs

Info

ID:	288290
PubChem CID:	104314746
Reduced:	FBr2N2H13C14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	391.91583
ΔH_f, kcal/mol:	9.49
Dipole, Da:	2.5
IP(EA), eV:	-9.24(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations