Geometry & MOs

Info

ID:	437180
PubChem CID:	135215486
Reduced:	SO3N5C17H25 (1)
Stoich.:	AB3C5D17E25 (1)
Weight, g/mol:	401.09916
ΔH_f, kcal/mol:	-66.41
Dipole, Da:	3.61
IP(EA), eV:	-9.05(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(fluoromethyl)cyclopropyl]-1-methyl-3-(3-methyl-1,2,4-thiadiazolidin-5-yl)-2-oxobenzimidazole-5-sulfonamide

Drug info:

PubChemData

Smile

CC1(CC1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N3C)CC4CCN(N4)C

DOS

IR

Vibrations