Geometry & MOs

Info

ID:	371443
PubChem CID:	127346360
Reduced:	ClN3O3C18H24 (1)
Stoich.:	AB3C3D18E24 (1)
Weight, g/mol:	305.148789
ΔH_f, kcal/mol:	-118.76
Dipole, Da:	5.36
IP(EA), eV:	-8.37(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-ethyl-1,3-oxazol-4-yl)-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

C1COCC1CC(=O)NCC(=O)N2CCN(CC2)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations