Geometry & MOs

Info

ID:	396714
PubChem CID:	135029064
Reduced:	N2O4C7H14 (1)
Stoich.:	A2B4C7D14 (1)
Weight, g/mol:	391.157229
ΔH_f, kcal/mol:	-162.72
Dipole, Da:	3.88
IP(EA), eV:	-9.54(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-nitrophenyl)-3,3-diphenyl-1,2-dihydroindene

Drug info:

PubChemData

Smile

C([C@H](CO/C=C/[C@@H](C(=O)[O-])[NH3+])N)O

DOS

IR

Vibrations