Geometry & MOs

Info

ID:	139397
PubChem CID:	52522056
Reduced:	N2S2O3F4H18C19 (1)
Stoich.:	A2B2C3D4E18F19 (1)
Weight, g/mol:	376.156912
ΔH_f, kcal/mol:	-249.48
Dipole, Da:	3.1
IP(EA), eV:	-9.02(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-sulfamoylpyrazol-1-yl)-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]propanamide

Drug info:

PubChemData

Smile

C1CN(CCN1C(=O)CCSC2=CC=CC=C2F)S(=O)(=O)C3=C(C(=C(C=C3)F)F)F

DOS

IR

Vibrations