Geometry & MOs

Info

ID:	429853
PubChem CID:	135169906
Reduced:	ClFON4H6C8 (1)
Stoich.:	ABCD4E6F8 (1)
Weight, g/mol:	381.09364
ΔH_f, kcal/mol:	56.84
Dipole, Da:	6.25
IP(EA), eV:	-8.94(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2E)-2-(aminomethylidene)-4,4,4-trifluoro-3-(4-nitronaphthalen-1-yl)iminobutanoate

Drug info:

PubChemData

Smile

C1=CNN(N1)C2=C(C=C(C(=C2)F)N=O)Cl

DOS

IR

Vibrations