Geometry & MOs

Info

ID:	235412
PubChem CID:	92708702
Reduced:	SN2O4C24H28 (1)
Stoich.:	AB2C4D24E28 (1)
Weight, g/mol:	464.097284
ΔH_f, kcal/mol:	-126.84
Dipole, Da:	10.73
IP(EA), eV:	-8.36(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)NC(=O)C[C@H](C)S(=O)(=O)C2=CC3=C(C=C2)N(CC3)C(=O)C4CC4

DOS

IR

Vibrations