Geometry & MOs

Info

ID:	327497
PubChem CID:	126690135
Reduced:	OSN6C26H34 (1)
Stoich.:	ABC6D26E34 (1)
Weight, g/mol:	438.200194
ΔH_f, kcal/mol:	71.42
Dipole, Da:	5.35
IP(EA), eV:	-8.36(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N,2-diethyl-3-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-N-methyl-6-N-propylimidazo[1,2-b]pyridazine-3,6-diamine

Drug info:

PubChemData

Smile

CCC1=C(N2C(=N1)C=CC(=N2)N3CCCC(C3)CO)N(C)C4=NC(=CS4)/C(=C/C=C(C)C)/C=C

DOS

IR

Vibrations