Geometry & MOs

Info

ID:

219793

PubChem CID:

85164902

Reduced:

N2Si2O5C31H62 (1)

Stoich.:

A2B2C5D31E62 (1)

Weight, g/mol:

598.216925

ΔHf, kcal/mol:

-293.71

Dipole, Da:

7.71

IP(EA), eV:

 -8.63(1.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[(2-chlorophenyl)methylcarbamothioyl]-N-[1-[methyl(naphthalen-1-ylmethyl)amino]-1-oxo-3-phenylpropan-2-yl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1C(C(C(N(C(=O)N1CC2CC2)CC3CC3)C(C)C)OCOCC[Si](C)(C)C)OCOCC[Si](C)(C)C

DOS

IR

Vibrations