Geometry & MOs

Info

ID:	359870
PubChem CID:	127299914
Reduced:	SO3N4C17H28 (1)
Stoich.:	AB3C4D17E28 (1)
Weight, g/mol:	364.247441
ΔH_f, kcal/mol:	-115.14
Dipole, Da:	4.8
IP(EA), eV:	-8.86(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]-1-morpholin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

CC1=CSC(=O)N1CCN2CCN(CC2)C(C)C(=O)N3CCOCC3

DOS

IR

Vibrations