Geometry & MOs

Info

ID:	324513
PubChem CID:	126677791
Reduced:	N3C7H8 (2)
Stoich.:	A3B7C8 (2)
Weight, g/mol:	253.132746
ΔH_f, kcal/mol:	82.09
Dipole, Da:	2.24
IP(EA), eV:	-8.29(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1-methylindazol-6-yl)methyl]pyridine-2,6-diamine

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=C2)CC3=CC(=NC(=C3N)N)N)C=N1

DOS

IR

Vibrations