Geometry & MOs

Info

ID:	342775
PubChem CID:	127265938
Reduced:	ClSN2O4C14H15 (1)
Stoich.:	ABC2D4E14F15 (1)
Weight, g/mol:	346.109962
ΔH_f, kcal/mol:	-105.97
Dipole, Da:	6.65
IP(EA), eV:	-10.24(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methyl-3-(1,3-oxazol-2-yl)phenyl]-1-propan-2-ylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Cl)S(=O)(=O)N(CCC#N)CC=C)C(=O)O

DOS

IR

Vibrations