Geometry & MOs

Info

ID:	246044
PubChem CID:	103037236
Reduced:	BrNO2C11H22 (1)
Stoich.:	ABC2D11E22 (1)
Weight, g/mol:	228.102941
ΔH_f, kcal/mol:	-110.65
Dipole, Da:	2.94
IP(EA), eV:	-8.76(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-3-(3-methoxy-3-methylbutyl)pyridin-2-amine

Drug info:

PubChemData

Smile

CC(C)(CCN1CCOC(C1)CBr)OC

DOS

IR

Vibrations