Geometry & MOs

Info

ID:	363567
PubChem CID:	127311646
Reduced:	O3N4C21H28 (1)
Stoich.:	A3B4C21D28 (1)
Weight, g/mol:	357.143704
ΔH_f, kcal/mol:	-101.66
Dipole, Da:	3.14
IP(EA), eV:	-8.62(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-(5-methyl-1,3-benzoxazol-2-yl)piperazin-1-yl]-2-oxoethyl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=N2)N3CCN(CC3)C(=O)CNC(=O)C4CCCCC4

DOS

IR

Vibrations