Geometry & MOs

Info

ID:	361955
PubChem CID:	127304951
Reduced:	N3O3C22H33 (1)
Stoich.:	A3B3C22D33 (1)
Weight, g/mol:	355.229348
ΔH_f, kcal/mol:	-127.46
Dipole, Da:	3.94
IP(EA), eV:	-8.51(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-3-propanoyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCN(C1)C(C)(C)CNC(=O)CN2C(=O)C3C4CC(C3C2=O)C=C4

DOS

IR

Vibrations