Geometry & MOs

Info

ID:	392223
PubChem CID:	135013755
Reduced:	NO3C8H13 (1)
Stoich.:	AB3C8D13 (1)
Weight, g/mol:	324.057356
ΔH_f, kcal/mol:	-61.95
Dipole, Da:	2.19
IP(EA), eV:	-10.34(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

naphthalen-1-yl-(2,3,4,5,6-pentafluorophenyl)methanol

Drug info:

PubChemData

Smile

C[C@@H](C=O)[C@H]1CCC[C@H]1[N+](=O)[O-]

DOS

IR

Vibrations