Geometry & MOs

Info

ID:	151780
PubChem CID:	56310581
Reduced:	FSO2N4H23C28 (1)
Stoich.:	ABC2D4E23F28 (1)
Weight, g/mol:	481.12269
ΔH_f, kcal/mol:	6.03
Dipole, Da:	3.38
IP(EA), eV:	-8.43(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[2-[4-(4-chlorobenzoyl)piperidin-1-yl]acetyl]amino]phenyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)CN(CC2=CC=C(C=C2)C#N)CC(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=CS4

DOS

IR

Vibrations