Geometry & MOs

Info

ID:	364829
PubChem CID:	127316237
Reduced:	ON6C16H18 (1)
Stoich.:	AB6C16D18 (1)
Weight, g/mol:	349.19026
ΔH_f, kcal/mol:	56.44
Dipole, Da:	6.08
IP(EA), eV:	-8.98(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,6-dimethylquinolin-3-yl)-[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=NC=CN2)C(=O)C3=NNC4=CC=CC=C43

DOS

IR

Vibrations