Geometry & MOs

Info

ID:	310012
PubChem CID:	126572772
Reduced:	ClON2H21C22 (1)
Stoich.:	ABC2D21E22 (1)
Weight, g/mol:	259.087829
ΔH_f, kcal/mol:	4.03
Dipole, Da:	2.6
IP(EA), eV:	-9.42(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-methyl-4-propan-2-yloxypyridin-3-yl)methyl methanesulfonate

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C1=CC(=CC(=C1)C2=CN=CC=C2)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations