Geometry & MOs

Info

ID:	436686
PubChem CID:	135207506
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	463.0272
ΔH_f, kcal/mol:	-32.67
Dipole, Da:	2.35
IP(EA), eV:	-8.76(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(6-chloro-3-iodo-2-methylimidazo[1,2-b]pyridazin-8-yl)imidazolidine-1-carboxylate

Drug info:

PubChemData

Smile

CN(C)C(CC1=CC=C(C=C1)O)CNC(=O)NCCC#C

DOS

IR

Vibrations