Geometry & MOs

Info

ID:	350369
PubChem CID:	127277447
Reduced:	O2N3C24H35 (1)
Stoich.:	A2B3C24D35 (1)
Weight, g/mol:	368.221226
ΔH_f, kcal/mol:	-93.63
Dipole, Da:	6.47
IP(EA), eV:	-8.99(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-oxo-3-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cinnolin-4-one

Drug info:

PubChemData

Smile

C1CCC(C1)C(=O)NCC2=CC=C(C=C2)C(=O)N3CCC(CC3)CN4CCCC4

DOS

IR

Vibrations