Geometry & MOs

Info

ID:	399359
PubChem CID:	135039804
Reduced:	O3C14H16 (1)
Stoich.:	A3B14C16 (1)
Weight, g/mol:	275.036955
ΔH_f, kcal/mol:	-105.65
Dipole, Da:	3.71
IP(EA), eV:	-9.81(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,3,4,5,6-pentafluorophenyl)-pyridin-4-ylmethanol

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=CC(=C1)[C@H]2C[C@@H](C=C2)O

DOS

IR

Vibrations