Geometry & MOs

Info

ID:	448925
PubChem CID:	135294536
Reduced:	N3O3C8H13 (1)
Stoich.:	A3B3C8D13 (1)
Weight, g/mol:	439.100037
ΔH_f, kcal/mol:	-32.87
Dipole, Da:	5.0
IP(EA), eV:	-9.62(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3-dichloropyridin-4-yl)sulfanyl-6-(3-methoxy-8-azaspiro[4.5]decan-8-yl)pyrazin-2-amine

Drug info:

PubChemData

Smile

C1COCCC1N=C/C(=C\N)/[N+](=O)[O-]

DOS

IR

Vibrations