Geometry & MOs

Info

ID:	168524
PubChem CID:	74982718
Reduced:	SO4N6C30H32 (1)
Stoich.:	AB4C6D30E32 (1)
Weight, g/mol:	550.155388
ΔH_f, kcal/mol:	-54.92
Dipole, Da:	5.68
IP(EA), eV:	-9.28(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[4-[6-[[2-(2-chlorophenyl)acetyl]amino]pyridazin-3-yl]butyl]-1,3,4-thiadiazol-2-yl]-2-(2-methoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)CC1=CC=CC(=C1)CC(=O)NC2=NN=C(C=C2)CCCCC3=NN=C(S3)NC(=O)CC4=CC=CC=C4

DOS

IR

Vibrations