Geometry & MOs

Info

ID:	240919
PubChem CID:	93618202
Reduced:	ON6C18H28 (1)
Stoich.:	AB6C18D28 (1)
Weight, g/mol:	286.142976
ΔH_f, kcal/mol:	22.72
Dipole, Da:	2.8
IP(EA), eV:	-8.45(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-2-(N-methylanilino)propyl]-6-oxo-1H-pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)[C@H](C)CNC(=O)C2=C(N(N=C2)C)N3C=CC=C3

DOS

IR

Vibrations