Geometry & MOs

Info

ID:	319405
PubChem CID:	126655871
Reduced:	NO2C24H25 (1)
Stoich.:	AB2C24D25 (1)
Weight, g/mol:	432.287574
ΔH_f, kcal/mol:	-31.08
Dipole, Da:	2.67
IP(EA), eV:	-8.64(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl (Z)-7-[(1R,2R,3S,5S)-3,5-dihydroxy-2-[(3R)-3-hydroxy-5-phenylpentyl]cyclopentyl]hept-5-enoate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2)C3=CC=CC=C3OC

DOS

IR

Vibrations