Geometry & MOs

Info

ID:	170920
PubChem CID:	75301117
Reduced:	O7C13H26 (1)
Stoich.:	A7B13C26 (1)
Weight, g/mol:	354.183109
ΔH_f, kcal/mol:	-286.13
Dipole, Da:	6.72
IP(EA), eV:	-9.77(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[2,2-dimethyl-6-(2-phenylethenyl)-1,3-dioxan-4-yl]prop-1-enyl]-2,3-dihydropyran-6-one

Drug info:

PubChemData

Smile

CC(C(C(C(C=C)O)OCOC)OCOC)OCOC

DOS

IR

Vibrations