Geometry & MOs

Info

ID:	154264
PubChem CID:	56313672
Reduced:	ClFSO2N3H19C20 (1)
Stoich.:	ABCD2E3F19G20 (1)
Weight, g/mol:	351.158292
ΔH_f, kcal/mol:	-49.72
Dipole, Da:	0.77
IP(EA), eV:	-9.29(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-nitroindol-1-yl)-N-(3-phenylbutyl)acetamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CSC1=NN=C(O1)C2=CC=C(C=C2)Cl)C3=CC=CC=C3F

DOS

IR

Vibrations