Geometry & MOs

Info

ID:	405183
PubChem CID:	135072919
Reduced:	ClSeN3H6C7 (1)
Stoich.:	ABC3D6E7 (1)
Weight, g/mol:	537.045734
ΔH_f, kcal/mol:	99.15
Dipole, Da:	2.31
IP(EA), eV:	-8.83(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trichloroethyl 7-[2-(2-chloro-1-methylindol-3-yl)propan-2-yl]-8-oxo-1,4-dioxaspiro[4.5]decane-9-carboxylate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1Cl)[Se]CN=[N+]=[N-]

DOS

IR

Vibrations