Geometry & MOs

Info

ID:	238580
PubChem CID:	92741985
Reduced:	SN3O5C23H31 (1)
Stoich.:	AB3C5D23E31 (1)
Weight, g/mol:	461.198442
ΔH_f, kcal/mol:	-183.08
Dipole, Da:	6.78
IP(EA), eV:	-9.13(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopropyl-[(2S)-2-methyl-5-[4-(morpholine-4-carbonyl)piperidin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]methanone

Drug info:

PubChemData

Smile

C[C@@H]1CC2=C(N1C(=O)C3CC3)C=CC(=C2)S(=O)(=O)N4CCC(CC4)C(=O)N5CCOCC5

DOS

IR

Vibrations