Geometry & MOs

Info

ID:	208251
PubChem CID:	80508291
Reduced:	N2C5H8 (3)
Stoich.:	A2B5C8 (3)
Weight, g/mol:	285.184112
ΔH_f, kcal/mol:	60.9
Dipole, Da:	3.88
IP(EA), eV:	-9.41(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2-tert-butyl-4-ethylphenoxy)pyridazin-4-yl]methanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations