Geometry & MOs

Info

ID:	355560
PubChem CID:	127289318
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	292.189926
ΔH_f, kcal/mol:	-30.5
Dipole, Da:	5.74
IP(EA), eV:	-8.79(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)C(=O)C3CCOC4=CC=CC=C34

DOS

IR

Vibrations