Geometry & MOs

Info

ID:	273651
PubChem CID:	103771571
Reduced:	NOSC7H9 (2)
Stoich.:	ABCD7E9 (2)
Weight, g/mol:	297.168856
ΔH_f, kcal/mol:	-48.24
Dipole, Da:	3.89
IP(EA), eV:	-9.4(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=CSC(=N1)C2=CC=CS2)O

DOS

IR

Vibrations