Geometry & MOs

Info

ID:	355642
PubChem CID:	127289400
Reduced:	O2N5C16H25 (1)
Stoich.:	A2B5C16D25 (1)
Weight, g/mol:	351.169525
ΔH_f, kcal/mol:	-67.17
Dipole, Da:	5.39
IP(EA), eV:	-8.8(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[(1-methylimidazol-2-yl)methyl]piperazine-1-carbonyl]-1H-quinolin-4-one

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)C(=O)CN3CCCCC3=O

DOS

IR

Vibrations