Geometry & MOs

Info

ID:	24260
PubChem CID:	608838
Reduced:	NC17H27 (1)
Stoich.:	AB17C27 (1)
Weight, g/mol:	245.21435
ΔH_f, kcal/mol:	-29.46
Dipole, Da:	1.13
IP(EA), eV:	-8.34(1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,4,4a,6,7,8,9,10,11,11b,12,13,13a-tetradecahydro-1H-isoquinolino[2,1-a]quinoline

Drug info:

PubChemData

Smile

C1CCC2C(C1)CCC3N2CCC4=C3CCCC4

DOS

IR

Vibrations