Geometry & MOs

Info

ID:	288312
PubChem CID:	104314905
Reduced:	N2Br3C15H15 (1)
Stoich.:	A2B3C15D15 (1)
Weight, g/mol:	411.99727
ΔH_f, kcal/mol:	53.71
Dipole, Da:	2.49
IP(EA), eV:	-9.28(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dibromopyridin-2-yl)-2-(2,5-dimethylphenyl)-N-ethylethanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations