Geometry & MOs

Info

ID:	434824
PubChem CID:	135175784
Reduced:	O3F4H8C11 (1)
Stoich.:	A3B4C8D11 (1)
Weight, g/mol:	572.093754
ΔH_f, kcal/mol:	-296.3
Dipole, Da:	3.8
IP(EA), eV:	-10.13(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-2-[6-(1,1-difluoropropyl)pyridin-3-yl]-5-[[1-[2-fluoro-4-(trifluoromethoxy)phenyl]cyclopropanecarbonyl]amino]benzoic acid

Drug info:

PubChemData

Smile

C1CC1(C2=C(C=C(C=C2)OC(F)(F)F)F)C(=O)O

DOS

IR

Vibrations