Geometry & MOs

Info

ID:	240707
PubChem CID:	93617163
Reduced:	ClSO2N3C13H16 (1)
Stoich.:	ABC2D3E13F16 (1)
Weight, g/mol:	309.114713
ΔH_f, kcal/mol:	-31.15
Dipole, Da:	6.05
IP(EA), eV:	-9.56(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(2-methoxyphenyl)propyl]-1-methylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC[C@H](C1=CC(=CC=C1)Cl)NS(=O)(=O)C2=CN(N=C2)C

DOS

IR

Vibrations