Geometry & MOs

Info

ID:	331143
PubChem CID:	127248550
Reduced:	FSN4O4C20H29 (1)
Stoich.:	ABC4D4E20F29 (1)
Weight, g/mol:	440.189355
ΔH_f, kcal/mol:	-152.67
Dipole, Da:	5.05
IP(EA), eV:	-9.07(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-2-[5-[2-(3-fluorophenoxy)ethyl]-1-methylpyrazol-3-yl]morpholine-4-sulfonamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)N1CCOC(C1)C2=NN(C(=C2)CCOC3=CC=CC=C3F)C

DOS

IR

Vibrations