Geometry & MOs

Info

ID:	130630
PubChem CID:	51091817
Reduced:	N3O3C17H25 (1)
Stoich.:	A3B3C17D25 (1)
Weight, g/mol:	340.044855
ΔH_f, kcal/mol:	-146.22
Dipole, Da:	4.29
IP(EA), eV:	-8.47(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-acetamido-N-[2-(5-chlorothiophen-2-yl)ethyl]-2-fluorobenzamide

Drug info:

PubChemData

Smile

CCC(=O)NC1=CC=C(C=C1)NC(=O)CNC(=O)CC(C)(C)C

DOS

IR

Vibrations