Geometry & MOs

Info

ID:	52621
PubChem CID:	12015560
Reduced:	NOC12H21 (1)
Stoich.:	ABC12D21 (1)
Weight, g/mol:	754.398701
ΔH_f, kcal/mol:	-75.42
Dipole, Da:	3.2
IP(EA), eV:	-9.57(2.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3,4,5-tris[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzoate

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)C(C3)(CN)O

DOS

IR

Vibrations