Geometry & MOs

Info

ID:	437181
PubChem CID:	135215489
Reduced:	FS2O3N5C15H20 (1)
Stoich.:	AB2C3D5E15F20 (1)
Weight, g/mol:	480.197731
ΔH_f, kcal/mol:	-109.6
Dipole, Da:	4.23
IP(EA), eV:	-9.02(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2,4-dimethyl-1,3-thiazolidin-5-yl)methyl]-N-(1-methylcyclopropyl)-3-(1-methylpyrazolidin-3-yl)-2-oxobenzimidazole-5-sulfonamide

Drug info:

PubChemData

Smile

CC1NC(SN1)N2C3=C(C=CC(=C3)S(=O)(=O)NC4(CC4)CF)N(C2=O)C

DOS

IR

Vibrations