Geometry & MOs

Info

ID:	175797
PubChem CID:	75949166
Reduced:	SO2N3C25H33 (1)
Stoich.:	AB2C3D25E33 (1)
Weight, g/mol:	392.161031
ΔH_f, kcal/mol:	-63.68
Dipole, Da:	4.37
IP(EA), eV:	-8.55(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

4-methyl-2-[[2-(3-naphthalen-1-yl-6-oxopyridazin-1-yl)acetyl]amino]pentanoate

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)NC(=O)C2CCC(=O)N(C2C3=CC=CS3)C4=CC=C(C=C4)C

DOS

IR

Vibrations