Geometry & MOs

Info

ID:	446998
PubChem CID:	135279413
Reduced:	F3O3N4C26H27 (1)
Stoich.:	A3B3C4D26E27 (1)
Weight, g/mol:	473.186318
ΔH_f, kcal/mol:	-173.16
Dipole, Da:	4.33
IP(EA), eV:	-8.76(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-2-[5-[[5-[2,6-dimethyl-4-(2-methyltetrazol-5-yl)phenyl]-2-fluorophenyl]methoxy]pyridin-2-yl]cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCONC(=O)C1=CC=C(C=C1)[C@H](C)NC2=NC=CC3=C2N(CCO3)CC4=CC=C(C=C4)C(F)(F)F

DOS

IR

Vibrations