Geometry & MOs

Info

ID:	282061
PubChem CID:	103915039
Reduced:	BrN3C17H20 (1)
Stoich.:	AB3C17D20 (1)
Weight, g/mol:	270.03678
ΔH_f, kcal/mol:	52.86
Dipole, Da:	1.9
IP(EA), eV:	-8.54(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-6-methyl-N-(oxolan-2-ylmethyl)pyridin-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)N2CCN(CC2)CC3=CC=CC=C3)Br

DOS

IR

Vibrations