Geometry & MOs

Info

ID:	179123
PubChem CID:	76438083
Reduced:	O3N5C15H19 (1)
Stoich.:	A3B5C15D19 (1)
Weight, g/mol:	355.128054
ΔH_f, kcal/mol:	-70.28
Dipole, Da:	5.7
IP(EA), eV:	-9.25(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-(1-methyl-2,6-dioxo-5H-pyrimidin-5-yl)-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]acetamide

Drug info:

PubChemData

Smile

C1CC1CN2CC3(CN(CC3C2=O)C4=NC=CC(=N4)N)C(=O)O

DOS

IR

Vibrations