Geometry & MOs

Info

ID:	418372
PubChem CID:	135104391
Reduced:	NSO5C16H23 (1)
Stoich.:	ABC5D16E23 (1)
Weight, g/mol:	344.120607
ΔH_f, kcal/mol:	-216.87
Dipole, Da:	3.58
IP(EA), eV:	-9.68(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-3-fluoro-5-methylbenzamide

Drug info:

PubChemData

Smile

CCC[C@@]1(CN(CC[C@H]1O)S(=O)(=O)C2=CC=C(C=C2)C)C(=O)O

DOS

IR

Vibrations