Geometry & MOs

Info

ID:	350731
PubChem CID:	127279019
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	274.135114
ΔH_f, kcal/mol:	-100.35
Dipole, Da:	4.62
IP(EA), eV:	-8.97(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethylpyrrolidin-1-yl)-3-(1,1-dioxo-1,2-thiazolidin-2-yl)propan-1-one

Drug info:

PubChemData

Smile

CC1(CCCN1C(=O)C2=C3C(=CC=C2)OCO3)C

DOS

IR

Vibrations