Geometry & MOs

Info

ID:	379634
PubChem CID:	134452547
Reduced:	ClN5H14C17 (1)
Stoich.:	AB5C14D17 (1)
Weight, g/mol:	347.074929
ΔH_f, kcal/mol:	133.33
Dipole, Da:	3.43
IP(EA), eV:	-9.18(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(7-chloro-1H-indazol-5-yl)-2-(difluoromethyl)-6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyridine

Drug info:

PubChemData

Smile

CC1=C(N2C(=NC(=N2)C3CC3)C=C1)C4=CC5=C(C(=C4)Cl)NN=C5

DOS

IR

Vibrations