Geometry & MOs

Info

ID:	227947
PubChem CID:	87563108
Reduced:	F2O3H14C16 (1)
Stoich.:	A2B3C14D16 (1)
Weight, g/mol:	311.103669
ΔH_f, kcal/mol:	-157.59
Dipole, Da:	2.49
IP(EA), eV:	-9.09(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-chloro-6-(3-morpholin-4-ylazetidin-1-yl)pyridine-4-carboxylate

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)C(C=O)C2=C(C=CC=C2F)F)OC

DOS

IR

Vibrations