Geometry & MOs

Info

ID:	167746
PubChem CID:	74868592
Reduced:	NO4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	271.110296
ΔH_f, kcal/mol:	-155.9
Dipole, Da:	2.86
IP(EA), eV:	-9.45(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C=CC(=O)NC(C(C)O)C(=O)O

DOS

IR

Vibrations