Geometry & MOs

Info

ID:	217420
PubChem CID:	85087787
Reduced:	NO3C23H23 (1)
Stoich.:	AB3C23D23 (1)
Weight, g/mol:	361.225308
ΔH_f, kcal/mol:	-38.7
Dipole, Da:	2.84
IP(EA), eV:	-9.38(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5a-methoxy-9a,11a-dimethyl-7-oxo-2,3,3a,3b,4,5,6,9b,10,11-decahydro-1H-indeno[5,4-f]quinoline-1-carboxylate

Drug info:

PubChemData

Smile

CC(=CC1=CC=CC=C1)C2C(C(=O)N2CC(=O)OCC3=CC=CC=C3)C=C

DOS

IR

Vibrations