Geometry & MOs

Info

ID:	153722
PubChem CID:	56313026
Reduced:	FN2O2C22H27 (1)
Stoich.:	AB2C2D22E27 (1)
Weight, g/mol:	350.083348
ΔH_f, kcal/mol:	-114.14
Dipole, Da:	2.46
IP(EA), eV:	-9.61(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[2-(2-fluorophenyl)-2-methylpropyl]-3-nitrobenzamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NCC(C)(C)C1=CC=CC=C1F)NC(=O)C2=CC=CC=C2

DOS

IR

Vibrations