Geometry & MOs

Info

ID:	153574
PubChem CID:	56312827
Reduced:	OF3N5C18H22 (1)
Stoich.:	AB3C5D18E22 (1)
Weight, g/mol:	433.149384
ΔH_f, kcal/mol:	-145.89
Dipole, Da:	5.1
IP(EA), eV:	-8.34(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyclopentylpiperazine-1-carbonyl)-N-(4-methylphenyl)thiophene-3-sulfonamide

Drug info:

PubChemData

Smile

CC(C)N1C(=C(C=N1)C(=O)NCC2=CN=C(C=C2)N3CCCC3)C(F)(F)F

DOS

IR

Vibrations