Geometry & MOs

Info

ID:	419141
PubChem CID:	135107589
Reduced:	N2O4C23H24 (1)
Stoich.:	A2B4C23D24 (1)
Weight, g/mol:	376.085971
ΔH_f, kcal/mol:	-116.11
Dipole, Da:	4.89
IP(EA), eV:	-8.64(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2-methoxybenzamide

Drug info:

PubChemData

Smile

CN1C=C(C2=CC=CC=C21)C(=O)N3CC[C@]([C@H](C3)O)(CC4=CC=CC=C4)C(=O)O

DOS

IR

Vibrations