Geometry & MOs

Info

ID:	154378
PubChem CID:	56313800
Reduced:	FO2N3C22H24 (1)
Stoich.:	AB2C3D22E24 (1)
Weight, g/mol:	418.172642
ΔH_f, kcal/mol:	-91.64
Dipole, Da:	4.81
IP(EA), eV:	-9.22(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-2-[2-(2-methoxyethylamino)-2-oxoethyl]sulfanylbenzamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CCCC1=NC(=O)C2=CC=CC=C2N1)C3=CC=CC=C3F

DOS

IR

Vibrations