Geometry & MOs

Info

ID:	253650
PubChem CID:	103119778
Reduced:	ClN6H11C14 (1)
Stoich.:	AB6C11D14 (1)
Weight, g/mol:	284.057722
ΔH_f, kcal/mol:	134.21
Dipole, Da:	7.0
IP(EA), eV:	-8.68(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-3-(1-methylindazol-3-yl)-[1,2,4]triazolo[4,3-a]pyrazine

Drug info:

PubChemData

Smile

CC1=NC(=CC2=NN=C(N12)C3=NN(C4=CC=CC=C43)C)Cl

DOS

IR

Vibrations