Geometry & MOs

Info

ID:	449805
PubChem CID:	135301665
Reduced:	N3C13H19 (1)
Stoich.:	A3B13C19 (1)
Weight, g/mol:	394.236876
ΔH_f, kcal/mol:	21.06
Dipole, Da:	2.9
IP(EA), eV:	-8.24(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[1-[7-(2,6-dimethylpyridin-4-yl)-2,7-diazaspiro[4.4]nonan-2-yl]ethyl]-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)N2CCC3(C2)CCNC3

DOS

IR

Vibrations