Geometry & MOs

Info

ID:	201179
PubChem CID:	79501581
Reduced:	BrN3C17H24 (1)
Stoich.:	AB3C17D24 (1)
Weight, g/mol:	251.163377
ΔH_f, kcal/mol:	19.33
Dipole, Da:	3.84
IP(EA), eV:	-8.82(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-aminopropan-2-yl)-2,4-diazaspiro[5.6]dodec-3-ene-1,5-dione

Drug info:

PubChemData

Smile

CCC1CCCC2(CC1)CN=C(N2C3=CC(=CC=C3)Br)N

DOS

IR

Vibrations