Geometry & MOs

Info

ID:	343675
PubChem CID:	127266851
Reduced:	SN3O3C14H17 (1)
Stoich.:	AB3C3D14E17 (1)
Weight, g/mol:	337.146013
ΔH_f, kcal/mol:	-74.3
Dipole, Da:	1.29
IP(EA), eV:	-9.67(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-[2-(hydroxymethyl)-3-(1-methylpyrazol-4-yl)propyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NCCCN2C=CC=NC2=O

DOS

IR

Vibrations