Geometry & MOs

Info

ID:	398355
PubChem CID:	135032928
Reduced:	N2O3H14C15 (1)
Stoich.:	A2B3C14D15 (1)
Weight, g/mol:	306.136828
ΔH_f, kcal/mol:	14.2
Dipole, Da:	6.03
IP(EA), eV:	-8.82(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(1S)-1-(nitromethyl)-3,4-dihydro-2H-naphthalen-1-yl]-1H-indole

Drug info:

PubChemData

Smile

C[C@](C[N+](=O)[O-])(C1=CC=CO1)C2=CNC3=CC=CC=C32

DOS

IR

Vibrations