Geometry & MOs

Info

ID:	240647
PubChem CID:	93616939
Reduced:	N3O3C15H17 (1)
Stoich.:	A3B3C15D17 (1)
Weight, g/mol:	257.072179
ΔH_f, kcal/mol:	-36.14
Dipole, Da:	2.66
IP(EA), eV:	-9.44(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(4-methoxyphenyl)-2-methylsulfonylpropanamide

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@H](O1)C)C(=O)C2=NOC(=C2)C3=CN=CC=C3

DOS

IR

Vibrations