Geometry & MOs

Info

ID:	310180
PubChem CID:	126576280
Reduced:	ClN6C26H37 (1)
Stoich.:	AB6C26D37 (1)
Weight, g/mol:	137.120449
ΔH_f, kcal/mol:	41.89
Dipole, Da:	4.26
IP(EA), eV:	-8.55(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methylbicyclo[3.2.1]oct-5-en-1-amine

Drug info:

PubChemData

Smile

C/C=C(\C1=C(C=C(C=C1)Cl)N=C)/NCCCCCCNC2=NC(=NC(=C2)C)N3CCCCC3

DOS

IR

Vibrations