Geometry & MOs

Info

ID:	227852
PubChem CID:	87562719
Reduced:	ClSF3N5O8C35H39 (1)
Stoich.:	ABC3D5E8F35G39 (1)
Weight, g/mol:	270.07712
ΔH_f, kcal/mol:	-375.97
Dipole, Da:	7.18
IP(EA), eV:	-8.39(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-chloro-6-(oxan-4-ylamino)pyridine-4-carboxylate

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2CCN(CC2)OC(=O)NC3(C4=CC(=C(C=C4N(C3=O)S(=O)(=O)C5=C(C=C(C=C5)OC)OC)F)Cl)C6=CC=CC=C6OCC(F)F

DOS

IR

Vibrations