Geometry & MOs

Info

ID:	256941
PubChem CID:	103142533
Reduced:	O3C14H24 (1)
Stoich.:	A3B14C24 (1)
Weight, g/mol:	256.193949
ΔH_f, kcal/mol:	-146.6
Dipole, Da:	4.35
IP(EA), eV:	-9.5(1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1CCC(O1)CC2(CCOC2C3CC3)CO

DOS

IR

Vibrations