Geometry & MOs

Info

ID:	149314
PubChem CID:	53788986
Reduced:	O2N4C29H30 (1)
Stoich.:	A2B4C29D30 (1)
Weight, g/mol:	349.261694
ΔH_f, kcal/mol:	13.38
Dipole, Da:	5.79
IP(EA), eV:	-7.77(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hydroxy-1-(1-hydroxyethyl)-6,9a,11a-trimethyl-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydroindeno[5,4-f]quinolin-7-one

Drug info:

PubChemData

Smile

CCN(CC)C1=CC=C(C=C1)C2=C(NC(=N2)C3=CC=C(C=C3)C=CC(=O)OC)C4=CC=C(C=C4)N

DOS

IR

Vibrations