Geometry & MOs

Info

ID:

180208

PubChem CID:

76596280

Reduced:

MnCl2N5C14H25 (1)

Stoich.:

AB2C5D14E25 (1)

Weight, g/mol:

292.120526

ΔHf, kcal/mol:

79.53

Dipole, Da:

6.35

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.796051

Charge, e:

 0

Chem-info

IUPAC name:

N-methyl-3-(morpholin-4-ylsulfonylamino)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CNCCNC2=CC=CC=C2NCCNCCN1.Cl[Mn]Cl

DOS

IR

Vibrations