Geometry & MOs

Info

ID:	355655
PubChem CID:	127289413
Reduced:	OSN8C15H22 (1)
Stoich.:	ABC8D15E22 (1)
Weight, g/mol:	315.169525
ΔH_f, kcal/mol:	89.83
Dipole, Da:	8.69
IP(EA), eV:	-9.18(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)C(=O)CSC3=NN=NN3C4CC4

DOS

IR

Vibrations