Geometry & MOs

Info

ID:	183911
PubChem CID:	77089074
Reduced:	ClN2O2C20H25 (1)
Stoich.:	AB2C2D20E25 (1)
Weight, g/mol:	314.199428
ΔH_f, kcal/mol:	-59.29
Dipole, Da:	5.14
IP(EA), eV:	-8.65(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethoxy-2-[[3-(methoxymethyl)piperidin-1-yl]methyl]quinoline

Drug info:

PubChemData

Smile

COCCCCN1CCN(CC1)C(=O)C2=CC=CC3=C2C=CC=C3Cl

DOS

IR

Vibrations