Geometry & MOs

Info

ID:	65106
PubChem CID:	29204477
Reduced:	N2S3O5C17H24 (1)
Stoich.:	A2B3C5D17E24 (1)
Weight, g/mol:	480.110139
ΔH_f, kcal/mol:	-196.58
Dipole, Da:	6.83
IP(EA), eV:	-9.3(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(difluoromethylsulfanyl)benzimidazol-1-yl]-N-(3-piperidin-1-ylsulfonylphenyl)acetamide

Drug info:

PubChemData

Smile

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CS[C@@H]3CCS(=O)(=O)C3

DOS

IR

Vibrations