Geometry & MOs

Info

ID:	421860
PubChem CID:	135116737
Reduced:	N2O6C23H30 (1)
Stoich.:	A2B6C23D30 (1)
Weight, g/mol:	327.125277
ΔH_f, kcal/mol:	-248.92
Dipole, Da:	7.86
IP(EA), eV:	-8.75(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)OC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)N[C@@]3(CCOC4([C@H]3O)CCNCC4)C

DOS

IR

Vibrations