Geometry & MOs

Info

ID:	225949
PubChem CID:	87246470
Reduced:	N5C17H19 (1)
Stoich.:	A5B17C19 (1)
Weight, g/mol:	232.022736
ΔH_f, kcal/mol:	105.95
Dipole, Da:	8.26
IP(EA), eV:	-8.84(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=C(N=NC3=NNC(=C23)N)C4=CC=CC=C4

DOS

IR

Vibrations