Geometry & MOs

Info

ID:	156140
PubChem CID:	56369294
Reduced:	ClSO3N5C23H26 (1)
Stoich.:	ABC3D5E23F26 (1)
Weight, g/mol:	430.172642
ΔH_f, kcal/mol:	-46.06
Dipole, Da:	6.03
IP(EA), eV:	-9.28(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[2-(2-fluorophenyl)cyclopropanecarbonyl]piperidin-3-yl]methyl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCCN(C2)C(=O)C3=C(N(N=N3)C4=CC(=CC=C4)Cl)C

DOS

IR

Vibrations