Geometry & MOs

Info

ID:	417895
PubChem CID:	135103027
Reduced:	FNSO5C13H16 (1)
Stoich.:	ABCD5E13F16 (1)
Weight, g/mol:	327.125277
ΔH_f, kcal/mol:	-249.48
Dipole, Da:	3.94
IP(EA), eV:	-10.07(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-3-methylpyridine-2-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations