Geometry & MOs

Info

ID:	88844
PubChem CID:	49957244
Reduced:	NO3C22H23 (1)
Stoich.:	AB3C22D23 (1)
Weight, g/mol:	307.157229
ΔH_f, kcal/mol:	-59.14
Dipole, Da:	7.77
IP(EA), eV:	-8.38(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,4-dimethoxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline

Drug info:

PubChemData

Smile

CC(=O)C1=CC2=C(C=C1)NC(C3C2C=CC3)C4=CC(=C(C=C4)OC)OC

DOS

IR

Vibrations