Geometry & MOs

Info

ID:	285035
PubChem CID:	104092307
Reduced:	NOC11H13 (1)
Stoich.:	ABC11D13 (1)
Weight, g/mol:	191.094629
ΔH_f, kcal/mol:	18.24
Dipole, Da:	4.81
IP(EA), eV:	-9.36(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-methoxypyridin-4-yl)pent-4-yn-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1)C#CCCCO

DOS

IR

Vibrations