Geometry & MOs

Info

ID:	216235
PubChem CID:	85085930
Reduced:	O3C15H16 (1)
Stoich.:	A3B15C16 (1)
Weight, g/mol:	244.109944
ΔH_f, kcal/mol:	-81.36
Dipole, Da:	2.65
IP(EA), eV:	-9.82(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-cyclodec-4-en-2,6-diyn-1-yloxybut-2-enoate

Drug info:

PubChemData

Smile

CCCC=CCC1(C(=O)C2=CC=CC=C2C1=O)O

DOS

IR

Vibrations