Geometry & MOs

Info

ID:	303744
PubChem CID:	124490124
Reduced:	NOC14H21 (1)
Stoich.:	ABC14D21 (1)
Weight, g/mol:	217.146664
ΔH_f, kcal/mol:	-41.14
Dipole, Da:	3.24
IP(EA), eV:	-8.91(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aS,10bS)-1-methyl-2,3,4,5,6,10b-hexahydrobenzo[h]quinolin-4a-ol

Drug info:

PubChemData

Smile

C[C@]([C@H]1CCCN(C1)C)(C2=CC=CC=C2)O

DOS

IR

Vibrations