Geometry & MOs

Info

ID:	288216
PubChem CID:	104313666
Reduced:	BrN3H14C16 (1)
Stoich.:	AB3C14D16 (1)
Weight, g/mol:	282.07316
ΔH_f, kcal/mol:	90.07
Dipole, Da:	4.7
IP(EA), eV:	-9.09(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromopyridin-2-yl)-1-cyclohexyl-N-methylmethanamine

Drug info:

PubChemData

Smile

CNC(C1=C2C=CC=NC2=CC=C1)C3=C(C=CC=N3)Br

DOS

IR

Vibrations