Geometry & MOs

Info

ID:	235773
PubChem CID:	92710591
Reduced:	S2N3O4C22H27 (1)
Stoich.:	A2B3C4D22E27 (1)
Weight, g/mol:	457.167142
ΔH_f, kcal/mol:	-136.36
Dipole, Da:	4.75
IP(EA), eV:	-9.31(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-acetyl-N-benzyl-N-methyl-5-morpholin-4-ylsulfonyl-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1[C@@H](CC2=C1C=CC(=C2)S(=O)(=O)N3CCCCC3)C(=O)NCCC4=CC=CS4

DOS

IR

Vibrations