Geometry & MOs

Info

ID:	407352
PubChem CID:	135079899
Reduced:	O4C13H16 (1)
Stoich.:	A4B13C16 (1)
Weight, g/mol:	462.225368
ΔH_f, kcal/mol:	-52.23
Dipole, Da:	2.56
IP(EA), eV:	-9.86(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tetraethyl 2-methyldodec-1-en-6,11-diyne-3,3,8,8-tetracarboxylate

Drug info:

PubChemData

Smile

CC(=C)COCC#CCOCC#CC(=O)OC

DOS

IR

Vibrations