Geometry & MOs

Info

ID:	414994
PubChem CID:	135087974
Reduced:	SO5N7C29H37 (1)
Stoich.:	AB5C7D29E37 (1)
Weight, g/mol:	374.106706
ΔH_f, kcal/mol:	-140.08
Dipole, Da:	4.21
IP(EA), eV:	-9.03(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-chlorophenyl)-N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]propanamide

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N[C@H](C(=O)N(CC(=O)N[C@H](C(=O)NCCCN1C(=O)C2=CN3C=CSC3=N2)CC4=CC=CC=C4)C)C(C)C

DOS

IR

Vibrations