Geometry & MOs

Info

ID:	407354
PubChem CID:	135079901
Reduced:	O4C15H18 (2)
Stoich.:	A4B15C18 (2)
Weight, g/mol:	390.183109
ΔH_f, kcal/mol:	-263.74
Dipole, Da:	3.02
IP(EA), eV:	-9.27(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1,3,4-tris(phenylmethoxy)butan-2-one

Drug info:

PubChemData

Smile

CCOC(=O)C(CC#C)(CC#CCC(CC(=C)C1=CC=CC=C1)(C(=O)OCC)C(=O)OCC)C(=O)OCC

DOS

IR

Vibrations