Geometry & MOs

Info

ID:	422380
PubChem CID:	135117719
Reduced:	NSO6C15H21 (1)
Stoich.:	ABC6D15E21 (1)
Weight, g/mol:	384.171893
ΔH_f, kcal/mol:	-253.12
Dipole, Da:	4.7
IP(EA), eV:	-9.11(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2-(2,3,6-trimethylphenoxy)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1OC)S(=O)(=O)N2CC[C@@H]([C@@H](C2)O)C(=O)O)C

DOS

IR

Vibrations