Geometry & MOs

Info

ID:	282066
PubChem CID:	103915089
Reduced:	BrON3C12H18 (1)
Stoich.:	ABC3D12E18 (1)
Weight, g/mol:	284.05243
ΔH_f, kcal/mol:	-44.79
Dipole, Da:	4.43
IP(EA), eV:	-8.63(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-6-methyl-N-[1-(oxolan-2-yl)ethyl]pyridin-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)NCC(=O)NC(C)(C)C)Br

DOS

IR

Vibrations