Geometry & MOs

Info

ID:	235413
PubChem CID:	92708715
Reduced:	ClFSN2O4C22H22 (1)
Stoich.:	ABCD2E4F22G22 (1)
Weight, g/mol:	464.097284
ΔH_f, kcal/mol:	-166.45
Dipole, Da:	8.88
IP(EA), eV:	-9.08(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(2-chloro-4-fluorophenyl)-3-[[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]sulfonyl]butanamide

Drug info:

PubChemData

Smile

C[C@@H](CC(=O)NC1=C(C=C(C=C1)F)Cl)S(=O)(=O)C2=CC3=C(C=C2)N(CC3)C(=O)C4CC4

DOS

IR

Vibrations