Geometry & MOs

Info

ID:	175787
PubChem CID:	75946910
Reduced:	BrSN2O3C17H17 (1)
Stoich.:	ABC2D3E17F17 (1)
Weight, g/mol:	414.11619
ΔH_f, kcal/mol:	-75.67
Dipole, Da:	4.15
IP(EA), eV:	-9.67(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(3-fluorophenyl)sulfamoyl]phenyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C=CCCC(=O)NCCN1C(=O)C(=CC2=CC(=CC=C2)Br)SC1=O

DOS

IR

Vibrations