Geometry & MOs

Info

ID:

414774

PubChem CID:

135087737

Reduced:

N4O4C22H29 (2)

Stoich.:

A4B4C22D29 (2)

Weight, g/mol:

333.081698

ΔHf, kcal/mol:

-284.41

Dipole, Da:

3.15

IP(EA), eV:

 -8.71(-0.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-4-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N[C@H](CN(CC(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC2=CC=C(C=C2)OC)CC(C)C)CC3=CNC4=CC=CC=C43)C(=O)C5=C(OC=N5)C(C)C)C(C)C

DOS

IR

Vibrations