Geometry & MOs

Info

ID:	405122
PubChem CID:	135072647
Reduced:	N2O3C12H14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	267.071842
ΔH_f, kcal/mol:	-42.44
Dipole, Da:	1.69
IP(EA), eV:	-8.42(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-(dimethylaminomethylidene)-5,5,5-trifluoro-2,4-dioxopentanoate

Drug info:

PubChemData

Smile

CC(=O)/C(=N\O)/C(=O)C1=CC(=CC=C1)N(C)C

DOS

IR

Vibrations