Geometry & MOs

Info

ID:	64264
PubChem CID:	29198763
Reduced:	SN3O3C17H25 (1)
Stoich.:	AB3C3D17E25 (1)
Weight, g/mol:	356.140593
ΔH_f, kcal/mol:	-95.15
Dipole, Da:	6.12
IP(EA), eV:	-8.44(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-[(2R)-4-methylsulfonyl-1-oxo-1-(propan-2-ylamino)butan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC(C)S(=O)(=O)NC[C@@H](C1=CNC2=CC=CC=C21)N3CCOCC3

DOS

IR

Vibrations