Geometry & MOs

Info

ID:	418322
PubChem CID:	135104188
Reduced:	NS2O5C16H23 (1)
Stoich.:	AB2C5D16E23 (1)
Weight, g/mol:	364.065984
ΔH_f, kcal/mol:	-200.81
Dipole, Da:	10.3
IP(EA), eV:	-9.84(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2-fluorobenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(S1)C)S(=O)(=O)N2CC[C@H]([C@@](C2)(CC3CC3)C(=O)O)O

DOS

IR

Vibrations