Geometry & MOs

Info

ID:	430689
PubChem CID:	135170755
Reduced:	NO3C11H17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	375.194677
ΔH_f, kcal/mol:	-131.89
Dipole, Da:	2.44
IP(EA), eV:	-9.83(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1-[4-(4-quinolin-3-ylphenoxy)piperidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CCCC(=O)OC1C=C(C(=O)N1C)CC

DOS

IR

Vibrations