Geometry & MOs

Info

ID:	399368
PubChem CID:	135039913
Reduced:	NH15C17 (1)
Stoich.:	AB15C17 (1)
Weight, g/mol:	252.958988
ΔH_f, kcal/mol:	57.15
Dipole, Da:	3.05
IP(EA), eV:	-8.21(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(2,2,2-trichloro-1-cyclopenta-1,4-dien-1-ylethyl) acetate

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2C3=CC4=CC=CC=C4N3C1

DOS

IR

Vibrations