Geometry & MOs

Info

ID:	261110
PubChem CID:	103217986
Reduced:	BrOSN3C12H12 (1)
Stoich.:	ABCD3E12F12 (1)
Weight, g/mol:	276.158626
ΔH_f, kcal/mol:	26.65
Dipole, Da:	7.07
IP(EA), eV:	-9.14(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CC2=NN(C(=O)C=C2NC1)CC3=CC=C(S3)Br

DOS

IR

Vibrations