Geometry & MOs

Info

ID:	154254
PubChem CID:	56313662
Reduced:	FON2S2C19H19 (1)
Stoich.:	ABC2D2E19F19 (1)
Weight, g/mol:	406.154015
ΔH_f, kcal/mol:	-21.73
Dipole, Da:	4.07
IP(EA), eV:	-9.14(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-3,4,5-trimethoxy-2-nitrobenzamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CC1=CSC(=N1)C2=CSC=C2)C3=CC=CC=C3F

DOS

IR

Vibrations