Geometry & MOs

Info

ID:	332457
PubChem CID:	127250743
Reduced:	SN4O4C19H28 (1)
Stoich.:	AB4C4D19E28 (1)
Weight, g/mol:	426.173705
ΔH_f, kcal/mol:	-108.06
Dipole, Da:	4.49
IP(EA), eV:	-9.08(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)N1CCOC(C1)C2=NNC(=C2)CCOC3=CC=CC=C3

DOS

IR

Vibrations