Geometry & MOs

Info

ID:	319599
PubChem CID:	126656769
Reduced:	ClFSO2N4C22H22 (1)
Stoich.:	ABCD2E4F22G22 (1)
Weight, g/mol:	209.21435
ΔH_f, kcal/mol:	-30.9
Dipole, Da:	7.44
IP(EA), eV:	-9.04(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-spiro[4.5]decan-8-ylpropan-2-amine

Drug info:

PubChemData

Smile

CC1(C(N(C(=S)N1C2=CC(=C(C=C2)OCC3(CC3)N)F)C4=CC(=C(C=C4)C#N)Cl)O)C

DOS

IR

Vibrations