Geometry & MOs

Info

ID:	143301
PubChem CID:	53182954
Reduced:	FSN3O3C17H20 (1)
Stoich.:	ABC3D3E17F20 (1)
Weight, g/mol:	448.097204
ΔH_f, kcal/mol:	-131.11
Dipole, Da:	9.19
IP(EA), eV:	-8.52(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-methylphenyl)-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-sulfonamide

Drug info:

PubChemData

Smile

CCN1CCCN2C=C(C=C2C1=O)S(=O)(=O)NC3=C(C=C(C=C3)C)F

DOS

IR

Vibrations