Geometry & MOs

Info

ID:	15148
PubChem CID:	430763
Reduced:	NC13H19 (2)
Stoich.:	AB13C19 (2)
Weight, g/mol:	378.303499
ΔH_f, kcal/mol:	1.52
Dipole, Da:	1.88
IP(EA), eV:	-7.89(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11,20-diazahexacyclo[18.8.0.02,11.03,8.013,18.023,28]octacosa-13,15,17-triene

Drug info:

PubChemData

Smile

C1CCC2C(C1)CCN3C2C4C5CCCCC5CCN4CC6=CC=CC=C6C3

DOS

IR

Vibrations