Geometry & MOs

Info

ID:	221642
PubChem CID:	85285808
Reduced:	BrSiO5C28H47 (1)
Stoich.:	ABC5D28E47 (1)
Weight, g/mol:	571.257003
ΔH_f, kcal/mol:	-306.99
Dipole, Da:	3.48
IP(EA), eV:	-8.81(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-benzyl 2-O-ethyl 3-(2-methoxy-2-oxoethyl)-4-[1-[4-(2-phenylethoxy)phenyl]ethenyl]pyrrolidine-1,2-dicarboxylate

Drug info:

PubChemData

Smile

CC1CC(CC(O1)CC(C(C)C(C(C)CO[Si](C)(C)C(C)(C)C)OC(=O)C2=CC=CC=C2)Br)OC

DOS

IR

Vibrations