Geometry & MOs

Info

ID:	190653
PubChem CID:	78036428
Reduced:	O3C5H10 (2)
Stoich.:	A3B5C10 (2)
Weight, g/mol:	378.167853
ΔH_f, kcal/mol:	-297.72
Dipole, Da:	1.14
IP(EA), eV:	-10.12(1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,4,13,13-tetramethyl-3,5,9,12,14-pentaoxatricyclo[8.4.0.02,6]tetradecan-7-yl) benzoate

Drug info:

PubChemData

Smile

CC(C)(O)OC1CC(C(OCC1O)CO)O

DOS

IR

Vibrations