Geometry & MOs

Info

ID:	155333
PubChem CID:	56352922
Reduced:	N3O4C28H33 (1)
Stoich.:	A3B4C28D33 (1)
Weight, g/mol:	430.236876
ΔH_f, kcal/mol:	-120.88
Dipole, Da:	4.6
IP(EA), eV:	-8.95(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2-morpholin-4-ylethyl)piperidin-1-yl]-(2-pyridin-3-ylquinolin-4-yl)methanone

Drug info:

PubChemData

Smile

C1CN(CCC1CCN2CCOCC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCC5=CC=CC=C5

DOS

IR

Vibrations