Geometry & MOs

Info

ID:	166392
PubChem CID:	74682789
Reduced:	ClSF3O3N4C26H26 (1)
Stoich.:	ABC3D3E4F26G26 (1)
Weight, g/mol:	316.182516
ΔH_f, kcal/mol:	-220.45
Dipole, Da:	3.04
IP(EA), eV:	-8.53(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

diethyl-[2-[[(4-fluorophenyl)-pyridin-3-ylmethylidene]amino]oxyethyl]azanium

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NN4C(CC(N=C4C3Cl)C5=CC=CC=C5)C(F)(F)F

DOS

IR

Vibrations