Geometry & MOs

Info

ID:	30346
PubChem CID:	841174
Reduced:	ON2C10H10 (2)
Stoich.:	AB2C10D10 (2)
Weight, g/mol:	311.107005
ΔH_f, kcal/mol:	25.95
Dipole, Da:	4.55
IP(EA), eV:	-8.66(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(4-cyanophenoxy)-N-[(2-fluorophenyl)methylideneamino]propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(C=NN2)C=NNC(=O)CC3=CC=C(C=C3)OC

DOS

IR

Vibrations