Geometry & MOs

Info

ID:	146868
PubChem CID:	53763782
Reduced:	O3C20H34 (1)
Stoich.:	A3B20C34 (1)
Weight, g/mol:	217.146664
ΔH_f, kcal/mol:	-155.74
Dipole, Da:	3.49
IP(EA), eV:	-9.42(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aS,10aS)-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-6-ol

Drug info:

PubChemData

Smile

CCC=CCC=CCC=CCCCCCCC(CCO)C(=O)O

DOS

IR

Vibrations