Geometry & MOs

Info

ID:	288273
PubChem CID:	104314512
Reduced:	Br2N2H12C13 (1)
Stoich.:	A2B2C12D13 (1)
Weight, g/mol:	397.98162
ΔH_f, kcal/mol:	54.56
Dipole, Da:	2.09
IP(EA), eV:	-9.28(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dibromopyridin-2-yl)-2-(2,4,6-trimethylphenyl)ethanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations