Geometry & MOs

Info

ID:	397718
PubChem CID:	135030613
Reduced:	N2F3O4H17C19 (1)
Stoich.:	A2B3C4D17E19 (1)
Weight, g/mol:	327.147058
ΔH_f, kcal/mol:	-278.87
Dipole, Da:	7.07
IP(EA), eV:	-9.42(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-[(2S)-1-ethoxy-1-oxopropan-2-yl]-4-methyl-5-phenylpyridine-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C2=CC=CC=C2C3=CC(=NC(=C31)C(F)(F)F)C(=O)OC

DOS

IR

Vibrations