Geometry & MOs

Info

ID:	421425
PubChem CID:	135115965
Reduced:	O3N5C20H23 (1)
Stoich.:	A3B5C20D23 (1)
Weight, g/mol:	354.037785
ΔH_f, kcal/mol:	-21.13
Dipole, Da:	8.65
IP(EA), eV:	-8.48(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)CCOC23CCN(CC3)C4=NC=NC5=C4NC=N5)OC

DOS

IR

Vibrations