Geometry & MOs

Info

ID:	363865
PubChem CID:	127313522
Reduced:	O2N4C21H28 (1)
Stoich.:	A2B4C21D28 (1)
Weight, g/mol:	362.231791
ΔH_f, kcal/mol:	-43.68
Dipole, Da:	9.36
IP(EA), eV:	-8.6(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C2=CC=CC=C21)C(=O)NCCN3CCN(CC3)C(=O)C4CCC4

DOS

IR

Vibrations