Geometry & MOs

Info

ID:	348960
PubChem CID:	127274686
Reduced:	SN3O3C17H27 (1)
Stoich.:	AB3C3D17E27 (1)
Weight, g/mol:	368.188212
ΔH_f, kcal/mol:	-93.07
Dipole, Da:	4.91
IP(EA), eV:	-8.8(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(3-butanoyl-1,3-thiazolidine-4-carbonyl)piperazin-1-yl]-N-cyclopropylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CN2CCN(CC2)C(=O)CSCC3CCCCO3

DOS

IR

Vibrations