Geometry & MOs

Info

ID:	288181
PubChem CID:	104313072
Reduced:	BrClN3C14H15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	340.03867
ΔH_f, kcal/mol:	56.14
Dipole, Da:	6.54
IP(EA), eV:	-9.38(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromopyridin-2-yl)-2-(3,4-difluorophenyl)-N-ethylethanamine

Drug info:

PubChemData

Smile

CCNC(CC1=C(C=NC=C1)Cl)C2=NC=C(C=C2)Br

DOS

IR

Vibrations