Geometry & MOs

Info

ID:	276671
PubChem CID:	103824656
Reduced:	O2N3C11H19 (1)
Stoich.:	A2B3C11D19 (1)
Weight, g/mol:	297.112484
ΔH_f, kcal/mol:	-90.23
Dipole, Da:	1.54
IP(EA), eV:	-9.73(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-5-fluoro-2-nitrobenzamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C(C)(C)C#N)C(=O)NC

DOS

IR

Vibrations