Geometry & MOs

Info

ID:	63604
PubChem CID:	26758737
Reduced:	SN2O5C24H28 (1)
Stoich.:	AB2C5D24E28 (1)
Weight, g/mol:	458.187543
ΔH_f, kcal/mol:	-168.86
Dipole, Da:	7.16
IP(EA), eV:	-8.4(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-[di(propan-2-yl)amino]-1-oxopropan-2-yl] 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate

Drug info:

PubChemData

Smile

C[C@H](C(=O)N1CCCCCC1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

DOS

IR

Vibrations