Geometry & MOs

Info

ID:	416212
PubChem CID:	135089222
Reduced:	FON4C12H19 (1)
Stoich.:	ABC4D12E19 (1)
Weight, g/mol:	367.121818
ΔH_f, kcal/mol:	-48.09
Dipole, Da:	3.94
IP(EA), eV:	-8.74(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]methyl]-3-propan-2-yl-1,2-oxazole

Drug info:

PubChemData

Smile

CN(CCN1CCCC1)C2=NC=C(C(=N2)OC)F

DOS

IR

Vibrations