Geometry & MOs

Info

ID:	384209
PubChem CID:	134976528
Reduced:	O2C11H12 (1)
Stoich.:	A2B11C12 (1)
Weight, g/mol:	1012.955048
ΔH_f, kcal/mol:	-41.2
Dipole, Da:	3.03
IP(EA), eV:	-9.02(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(phenylmethoxymethyl)-1,4-dioxacyclotetrahexaconta-33,35-diyne

Drug info:

PubChemData

Smile

C/C=C(/C=O)\C1=CC(=CC=C1)OC

DOS

IR

Vibrations