Geometry & MOs

Info

ID:	333938
PubChem CID:	127252490
Reduced:	N3O3C19H23 (1)
Stoich.:	A3B3C19D23 (1)
Weight, g/mol:	340.195092
ΔH_f, kcal/mol:	-70.52
Dipole, Da:	3.24
IP(EA), eV:	-8.7(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-fluorophenyl)methyl]-8-(pyridin-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane

Drug info:

PubChemData

Smile

CC1=NC(=CO1)C(=O)N2C[C@@H]([C@@H]3[C@H]2CCNC3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations