Geometry & MOs

Info

ID:	123231
PubChem CID:	50838723
Reduced:	S2N3O5C21H25 (1)
Stoich.:	A2B3C5D21E25 (1)
Weight, g/mol:	445.076613
ΔH_f, kcal/mol:	-159.12
Dipole, Da:	8.06
IP(EA), eV:	-9.21(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-(benzenesulfonyl)pyridazin-3-yl]sulfanyl-N-(3,5-dimethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(C=C2)S(=O)(=O)C3CCCCC3

DOS

IR

Vibrations