Geometry & MOs

Info

ID:	416891
PubChem CID:	135090734
Reduced:	ON5C18H33 (1)
Stoich.:	AB5C18D33 (1)
Weight, g/mol:	342.124943
ΔH_f, kcal/mol:	-39.38
Dipole, Da:	4.11
IP(EA), eV:	-8.37(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-3-hydroxy-2-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(N=CN1)CN(CCN(C)C)C(=O)C(C)N2CCCCCC2

DOS

IR

Vibrations