Geometry & MOs

Info

ID:	414695
PubChem CID:	135087654
Reduced:	N3O3C21H25 (1)
Stoich.:	A3B3C21D25 (1)
Weight, g/mol:	326.130028
ΔH_f, kcal/mol:	-100.39
Dipole, Da:	2.1
IP(EA), eV:	-8.71(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC(=O)CC(=O)N[C@H]2COC[C@H]2CC3=CC=NC=C3)C

DOS

IR

Vibrations