Geometry & MOs

Info

ID:	422460
PubChem CID:	135117873
Reduced:	FNSO5C17H22 (1)
Stoich.:	ABCD5E17F22 (1)
Weight, g/mol:	364.065984
ΔH_f, kcal/mol:	-236.62
Dipole, Da:	10.19
IP(EA), eV:	-10.07(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-5-fluorobenzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N2CC[C@@H]([C@@](C2)(CC3CC3)C(=O)O)O)F

DOS

IR

Vibrations