Geometry & MOs

Info

ID:	411068
PubChem CID:	135083878
Reduced:	OC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	192.11503
ΔH_f, kcal/mol:	-58.66
Dipole, Da:	2.27
IP(EA), eV:	-9.83(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-but-2-ynoxy-2-(but-2-ynoxymethyl)prop-1-ene

Drug info:

PubChemData

Smile

CC(=C)CC(CC=C1CC1)C(=O)OC

DOS

IR

Vibrations