Geometry & MOs

Info

ID:	264445
PubChem CID:	103462334
Reduced:	NC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	301.119319
ΔH_f, kcal/mol:	-3.36
Dipole, Da:	2.55
IP(EA), eV:	-8.3(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[5-chloro-4-(2,2-dimethylbutylamino)-6-oxopyridazin-1-yl]acetate

Drug info:

PubChemData

Smile

CCC(C)(C)CNC1=C(C=CC=N1)C

DOS

IR

Vibrations