Geometry & MOs

Info

ID:	331140
PubChem CID:	127248547
Reduced:	SN4O5C19H28 (1)
Stoich.:	AB4C5D19E28 (1)
Weight, g/mol:	428.128504
ΔH_f, kcal/mol:	-134.05
Dipole, Da:	5.23
IP(EA), eV:	-8.52(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[2-(4-chlorophenoxy)ethyl]-1-methylpyrazol-3-yl]-N,N-dimethylmorpholine-4-sulfonamide

Drug info:

PubChemData

Smile

CN1C(=CC(=N1)C2CN(CCO2)S(=O)(=O)N(C)C)CCOC3=CC=C(C=C3)OC

DOS

IR

Vibrations