Geometry & MOs

Info

ID:	356218
PubChem CID:	127291254
Reduced:	O2S2N3C19H33 (1)
Stoich.:	A2B2C3D19E33 (1)
Weight, g/mol:	382.203862
ΔH_f, kcal/mol:	-111.87
Dipole, Da:	1.18
IP(EA), eV:	-8.53(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-acetylpiperazin-1-yl)ethyl]-3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)N1CSCC1C(=O)NCC2(CCCC2)N3CCSCC3

DOS

IR

Vibrations