Geometry & MOs

Info

ID:	355554
PubChem CID:	127289312
Reduced:	ON2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	386.211804
ΔH_f, kcal/mol:	-48.8
Dipole, Da:	1.37
IP(EA), eV:	-8.6(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(3-fluorophenyl)oxan-4-yl]-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)C(=O)CC3CCCC4=C3C=CC(=C4)OC

DOS

IR

Vibrations