Geometry & MOs

Info

ID:	147963
PubChem CID:	53787624
Reduced:	ClN4O4C15H19 (1)
Stoich.:	AB4C4D15E19 (1)
Weight, g/mol:	366.145868
ΔH_f, kcal/mol:	-114.0
Dipole, Da:	5.96
IP(EA), eV:	-9.24(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-5-[3-[2-(3,4-dimethoxyphenyl)ethylamino]propylamino]-1H-pyridazin-6-one

Drug info:

PubChemData

Smile

CN(C)CCNC1=NC(C(N1)C2=CC=C(C=C2)Cl)OC(=O)C(=O)O

DOS

IR

Vibrations