Geometry & MOs

Info

ID:	170889
PubChem CID:	75294808
Reduced:	FO3N4C18H23 (1)
Stoich.:	AB3C4D18E23 (1)
Weight, g/mol:	338.07428
ΔH_f, kcal/mol:	-94.7
Dipole, Da:	2.6
IP(EA), eV:	-9.33(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-ethylidene-7-iodoheptanoate

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C2=CC=C(C=C2)F)COC3CC(NN3)C(=O)NC(C)C

DOS

IR

Vibrations