Geometry & MOs

Info

ID:	17406
PubChem CID:	496440
Reduced:	O6C33H40 (1)
Stoich.:	A6B33C40 (1)
Weight, g/mol:	532.282489
ΔH_f, kcal/mol:	-224.81
Dipole, Da:	3.1
IP(EA), eV:	-9.23(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-hydroxy-2-[2-hydroxy-3-phenylmethoxy-2-(phenylmethoxymethyl)cyclopentyl]-3-methyl-5-phenylpentanoate

Drug info:

PubChemData

Smile

CC(CCC1=CC=CC=C1)(C(C2CCC(C2(COCC3=CC=CC=C3)O)OCC4=CC=CC=C4)C(=O)OC)O

DOS

IR

Vibrations