Geometry & MOs

Info

ID:	185690
PubChem CID:	77333255
Reduced:	NO3C21H31 (1)
Stoich.:	AB3C21D31 (1)
Weight, g/mol:	345.230394
ΔH_f, kcal/mol:	-99.72
Dipole, Da:	5.61
IP(EA), eV:	-9.18(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-cyclopropyloxy-4-hydroxy-9a,11a-dimethyl-1,2,3,3a,3b,4,6,8,9,9b,10,11-dodecahydroindeno[5,4-f]quinolin-7-one

Drug info:

PubChemData

Smile

CC12CCCC1C3C(CC2)C4(C(CC(=O)NC4=CC3O)OC5CC5)C

DOS

IR

Vibrations