Geometry & MOs

Info

ID:	153374
PubChem CID:	56312561
Reduced:	ClFO2N3H25C26 (1)
Stoich.:	ABC2D3E25F26 (1)
Weight, g/mol:	468.11775
ΔH_f, kcal/mol:	-35.82
Dipole, Da:	4.61
IP(EA), eV:	-9.16(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)/C=C/C2=CC(=C(C=C2)OC3=CN=CC=C3)F)CC4=CC=C(C=C4)Cl

DOS

IR

Vibrations