Geometry & MOs

Info

ID:	360829
PubChem CID:	127301481
Reduced:	SN4O4C13H22 (1)
Stoich.:	AB4C4D13E22 (1)
Weight, g/mol:	358.167477
ΔH_f, kcal/mol:	-120.95
Dipole, Da:	2.92
IP(EA), eV:	-9.26(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-2-[4-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CCNC(=O)CN1CCN(CC1)S(=O)(=O)CC2=CC(=NO2)C

DOS

IR

Vibrations