Geometry & MOs

Info

ID:	416835
PubChem CID:	135090529
Reduced:	N2O3C22H22 (1)
Stoich.:	A2B3C22D22 (1)
Weight, g/mol:	354.161329
ΔH_f, kcal/mol:	-68.81
Dipole, Da:	3.37
IP(EA), eV:	-9.21(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-3-propan-2-ylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)O)C(=O)N[C@H]2COC[C@H]2CC3=CC=NC4=CC=CC=C34

DOS

IR

Vibrations