Geometry & MOs

Info

ID:

422294

PubChem CID:

135117570

Reduced:

SO7N8C39H56 (1)

Stoich.:

AB7C8D39E56 (1)

Weight, g/mol:

329.104542

ΔHf, kcal/mol:

-280.95

Dipole, Da:

10.76

IP(EA), eV:

 -9.02(-1.51)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-5-hydroxypyridine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@H]1C(=O)N[C@H](C(=O)N[C@@H](C(=O)N(CCN(CC(=O)N[C@H](C2=NC(=CS2)C(=O)N1)CC3=CC=CC=C3)C(=O)CCC(=O)N(C)C4CCCCC4)C)C)C(C)C

DOS

IR

Vibrations