Geometry & MOs

Info

ID:	89625
PubChem CID:	49963136
Reduced:	NO2C16H17 (1)
Stoich.:	AB2C16D17 (1)
Weight, g/mol:	318.16198
ΔH_f, kcal/mol:	-21.26
Dipole, Da:	6.05
IP(EA), eV:	-9.43(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-phenoxyphenyl)-(4-propan-2-ylphenyl)methanol

Drug info:

PubChemData

Smile

CCCCC1=CC=C(O1)C(C2=CC=C(C=C2)C#N)O

DOS

IR

Vibrations