Geometry & MOs

Info

ID:	390507
PubChem CID:	134999472
Reduced:	NO2C22H25 (1)
Stoich.:	AB2C22D25 (1)
Weight, g/mol:	430.154702
ΔH_f, kcal/mol:	-16.32
Dipole, Da:	1.67
IP(EA), eV:	-9.06(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dipropyl 2-[(1R)-1-(2-chlorophenyl)-3-oxo-3-phenylpropyl]propanedioate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@H]1C(N1CC2=CC=CC=C2)C=CC3=CC=CC=C3

DOS

IR

Vibrations