Geometry & MOs

Info

ID:

47304

PubChem CID:

10531344

Reduced:

N2O5C36H42 (1)

Stoich.:

A2B5C36D42 (1)

Weight, g/mol:

582.255229

ΔHf, kcal/mol:

-169.95

Dipole, Da:

4.17

IP(EA), eV:

 -9.28(-0.55)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

prop-2-enyl (2S,4S)-2-[(Z)-2-methyl-3-(prop-2-enoxycarbonylamino)prop-1-enyl]-4-tritylsulfanylpyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@@H](CCC(=O)NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)/C=C/C(=O)OC4CCCC4

DOS

IR

Vibrations