Geometry & MOs

Info

ID:	359751
PubChem CID:	127299698
Reduced:	O4N5C18H19 (1)
Stoich.:	A4B5C18D19 (1)
Weight, g/mol:	292.142307
ΔH_f, kcal/mol:	-107.5
Dipole, Da:	5.81
IP(EA), eV:	-9.32(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dioxan-2-ylmethyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1=O)CC(=O)N2CCN(CC2)C(=O)C3=CN4C=CN=C4C=C3

DOS

IR

Vibrations