Geometry & MOs

Info

ID:	415343
PubChem CID:	135088337
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	366.103162
ΔH_f, kcal/mol:	-14.9
Dipole, Da:	4.05
IP(EA), eV:	-9.35(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-1,5-dimethylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CO[C@@H]1CCC[C@]12CCCN(C2)C(=O)CN3N=C4C=CC=CC4=N3

DOS

IR

Vibrations