Geometry & MOs

Info

ID:	208247
PubChem CID:	80508287
Reduced:	F3N5C13H16 (1)
Stoich.:	A3B5C13D16 (1)
Weight, g/mol:	281.164046
ΔH_f, kcal/mol:	-80.14
Dipole, Da:	5.27
IP(EA), eV:	-9.8(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5,6-diethyl-3-indazol-1-ylpyridazin-4-yl)methanamine

Drug info:

PubChemData

Smile

CCC1=C(N=NC(=C1CN)N2C=CC(=N2)C(F)(F)F)CC

DOS

IR

Vibrations