Geometry & MOs

Info

ID:	411378
PubChem CID:	135084201
Reduced:	OSC5H5 (2)
Stoich.:	ABC5D5 (2)
Weight, g/mol:	205.110279
ΔH_f, kcal/mol:	-7.5
Dipole, Da:	1.85
IP(EA), eV:	-8.27(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methoxyphenyl)-N,2-dimethylprop-2-enamide

Drug info:

PubChemData

Smile

C1C[S@@](=O)C(=CC2=CC=CC=C2)[S@@]1=O

DOS

IR

Vibrations