Geometry & MOs

Info

ID:	89610
PubChem CID:	49963064
Reduced:	ON2H14C15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	266.141913
ΔH_f, kcal/mol:	36.33
Dipole, Da:	1.88
IP(EA), eV:	-9.06(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

naphthalen-1-yl-(2-propan-2-ylpyrazol-3-yl)methanol

Drug info:

PubChemData

Smile

CN1C(=CC=N1)C(C2=CC=CC3=CC=CC=C32)O

DOS

IR

Vibrations