Geometry & MOs

Info

ID:	328618
PubChem CID:	126726021
Reduced:	O2F7C12H17 (1)
Stoich.:	A2B7C12D17 (1)
Weight, g/mol:	469.172559
ΔH_f, kcal/mol:	-502.37
Dipole, Da:	4.34
IP(EA), eV:	-11.13(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[5-(4-ethoxyphenyl)pyridin-2-yl]-1,1-difluoro-2-(2-fluoro-4-methylphenyl)-3-(tetrazol-1-yl)propan-2-ol

Drug info:

PubChemData

Smile

CCC(C)(C)C(=O)OCC(CC(CC(F)(F)F)(F)F)(F)F

DOS

IR

Vibrations