Geometry & MOs

Info

ID:	258942
PubChem CID:	103157486
Reduced:	NOC16H33 (1)
Stoich.:	ABC16D33 (1)
Weight, g/mol:	284.02727
ΔH_f, kcal/mol:	-112.04
Dipole, Da:	1.7
IP(EA), eV:	-9.03(2.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-2-methoxypropan-1-amine

Drug info:

PubChemData

Smile

CCCCCCC(C)NCC(CC1CCCC1)O

DOS

IR

Vibrations