Geometry & MOs

Info

ID:	366588
PubChem CID:	127320117
Reduced:	N3O3C15H23 (1)
Stoich.:	A3B3C15D23 (1)
Weight, g/mol:	267.104148
ΔH_f, kcal/mol:	-101.51
Dipole, Da:	2.63
IP(EA), eV:	-9.3(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-oxo-3-[4-(pyrrolidine-1-carbonyl)-1,3-thiazolidin-3-yl]propanenitrile

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CC(=O)NCCC(=O)N2CCCCCC2

DOS

IR

Vibrations