Geometry & MOs

Info

ID:	30251
PubChem CID:	841045
Reduced:	Cl2O2N3H13C15 (1)
Stoich.:	A2B2C3D13E15 (1)
Weight, g/mol:	341.153955
ΔH_f, kcal/mol:	-37.23
Dipole, Da:	2.1
IP(EA), eV:	-9.07(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-N-[1-[3-(2-methylpropanoylamino)phenyl]ethylideneamino]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)NNC(=O)C2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations