Geometry & MOs

Info

ID:	364724
PubChem CID:	127316030
Reduced:	OSN8C14H20 (1)
Stoich.:	ABC8D14E20 (1)
Weight, g/mol:	324.195011
ΔH_f, kcal/mol:	89.76
Dipole, Da:	6.12
IP(EA), eV:	-9.21(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone

Drug info:

PubChemData

Smile

C1CC1N2C(=NN=N2)SCC(=O)N3CCN(CC3)CC4=NC=CN4

DOS

IR

Vibrations