Geometry & MOs

Info

ID:	311265
PubChem CID:	126590102
Reduced:	N4O7C19H28 (1)
Stoich.:	A4B7C19D28 (1)
Weight, g/mol:	560.341421
ΔH_f, kcal/mol:	-293.53
Dipole, Da:	4.26
IP(EA), eV:	-9.19(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[2-(2-ethoxyethoxymethyl)-5-ethyl-3-[4-[2-(4-fluorophenyl)ethoxy]phenyl]-6-methylpyridin-4-yl]-7-azaspiro[3.5]nonane

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)CNCCCCC[C@@H](C(=O)O)NC(=O)N[C@@H](CCC(=O)O)C(=O)O

DOS

IR

Vibrations