Geometry & MOs

Info

ID:	236747
PubChem CID:	92714620
Reduced:	SN2O3C18H26 (1)
Stoich.:	AB2C3D18E26 (1)
Weight, g/mol:	394.156243
ΔH_f, kcal/mol:	-132.56
Dipole, Da:	4.12
IP(EA), eV:	-9.21(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S)-1-(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylpiperidine-2-carboxylate

Drug info:

PubChemData

Smile

CC[C@H]1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3(C)C)C

DOS

IR

Vibrations