Geometry & MOs

Info

ID:	216763
PubChem CID:	85086740
Reduced:	ON3C7H10 (2)
Stoich.:	AB3C7D10 (2)
Weight, g/mol:	300.127406
ΔH_f, kcal/mol:	23.64
Dipole, Da:	2.03
IP(EA), eV:	-8.99(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-(4-fluorophenyl)-2-(phenylhydrazinylidene)propanoate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2C(C(NN2)NCCO)N3C=NC=N3

DOS

IR

Vibrations