Geometry & MOs

Info

ID:	57591
PubChem CID:	22425641
Reduced:	OSN4C9H12 (1)
Stoich.:	ABC4D9E12 (1)
Weight, g/mol:	433.112999
ΔH_f, kcal/mol:	22.87
Dipole, Da:	2.79
IP(EA), eV:	-8.78(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-acetylphenyl)-2-(6-cyclohexylsulfonylpyridazin-3-yl)sulfanylacetamide

Drug info:

PubChemData

Smile

CC(C)(C)SC1=NN2C(=NNC2=O)C=C1

DOS

IR

Vibrations