Geometry & MOs

Info

ID:	219740
PubChem CID:	85164722
Reduced:	N5O5C32H43 (1)
Stoich.:	A5B5C32D43 (1)
Weight, g/mol:	577.195666
ΔH_f, kcal/mol:	-170.17
Dipole, Da:	5.73
IP(EA), eV:	-8.3(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 2-(2-methyl-3-methylsulfonyloxyprop-1-enyl)-4-tritylsulfanylpyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(OC(=N1)C(CC2=CNC3=CC=CC=C32)NC(=O)C(CC(C)C)NC(=O)N4CCCCCC4)C5CC5

DOS

IR

Vibrations