Geometry & MOs

Info

ID:	30014
PubChem CID:	838894
Reduced:	N4O5C12H16 (1)
Stoich.:	A4B5C12D16 (1)
Weight, g/mol:	337.131408
ΔH_f, kcal/mol:	-30.53
Dipole, Da:	7.05
IP(EA), eV:	-9.37(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-hydroxy-3-[(2R)-6-methoxy-5-methyl-1-oxo-3,4-dihydro-2H-naphthalen-2-yl]-1H-indol-2-one

Drug info:

PubChemData

Smile

CON1[C@H](OC(=N1)N2CCCCC2)C3=CC=C(O3)[N+](=O)[O-]

DOS

IR

Vibrations