Geometry & MOs

Info

ID:	308642
PubChem CID:	126497239
Reduced:	SN4H30C36 (1)
Stoich.:	AB4C30D36 (1)
Weight, g/mol:	125.120449
ΔH_f, kcal/mol:	303.99
Dipole, Da:	3.27
IP(EA), eV:	-7.78(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7S)-7-methyl-4-azaspiro[2.5]octane

Drug info:

PubChemData

Smile

C1CC(=CC=C1)N2C3C=CC=CC3N(S24N(C5=CC=CC=C5N4C6=C=C=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8

DOS

IR

Vibrations