Geometry & MOs

Info

ID:	49362
PubChem CID:	11532916
Reduced:	Cl2F4N4H16C21 (1)
Stoich.:	A2B4C4D16E21 (1)
Weight, g/mol:	434.092137
ΔH_f, kcal/mol:	-147.07
Dipole, Da:	5.92
IP(EA), eV:	-8.94(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-chloro-3-(trifluoromethyl)phenyl]-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine

Drug info:

PubChemData

Smile

CC1=NN(C2=CC(=NC(=C12)NC3=CC(=C(C=C3)Cl)C(F)(F)F)C4=CC=C(C=C4)F)C.Cl

DOS

IR

Vibrations