Geometry & MOs

Info

ID:	266982
PubChem CID:	103580297
Reduced:	BrClON3C13H17 (1)
Stoich.:	ABCD3E13F17 (1)
Weight, g/mol:	306.01345
ΔH_f, kcal/mol:	-10.62
Dipole, Da:	2.12
IP(EA), eV:	-8.72(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-bromo-3-chloropyridin-2-yl)amino]-4-methylpentan-1-ol

Drug info:

PubChemData

Smile

C1CN(CC1N2CCOCC2)C3=C(C=C(C=N3)Br)Cl

DOS

IR

Vibrations