Geometry & MOs

Info

ID:	395238
PubChem CID:	135024997
Reduced:	N5O5C33H35 (1)
Stoich.:	A5B5C33D35 (1)
Weight, g/mol:	265.110279
ΔH_f, kcal/mol:	-144.76
Dipole, Da:	10.26
IP(EA), eV:	-8.55(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-benzyl-3-ethenyl-3-hydroxyindol-2-one

Drug info:

PubChemData

Smile

C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@H]5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C

DOS

IR

Vibrations