Geometry & MOs

Info

ID:	131287
PubChem CID:	51186959
Reduced:	N2S2O3C18H22 (1)
Stoich.:	A2B2C3D18E22 (1)
Weight, g/mol:	350.163043
ΔH_f, kcal/mol:	-83.39
Dipole, Da:	2.66
IP(EA), eV:	-8.98(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-oxo-3-pyrrolidin-1-ylpropyl)-9H-xanthene-9-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1)CN(C)C(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C

DOS

IR

Vibrations