Geometry & MOs

Info

ID:	43402
PubChem CID:	10321238
Reduced:	SF2N2O5C20H26 (1)
Stoich.:	AB2C2D5E20F26 (1)
Weight, g/mol:	444.204907
ΔH_f, kcal/mol:	-265.75
Dipole, Da:	2.71
IP(EA), eV:	-8.68(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-[(2E)-2-[phenyl(pyridin-3-yl)methoxy]iminopropyl]-5,6,7,8-tetrahydronaphthalen-1-yl]oxy]acetic acid

Drug info:

PubChemData

Smile

CC[C@]12CCC3C(C1CCC2(F)F)C/C(=N/O)/C4=CC(=C(C=C34)OC)OS(=O)(=O)N

DOS

IR

Vibrations