Geometry & MOs

Info

ID:	369450
PubChem CID:	127333428
Reduced:	O2S2N3C14H19 (1)
Stoich.:	A2B2C3D14E19 (1)
Weight, g/mol:	391.240582
ΔH_f, kcal/mol:	-55.58
Dipole, Da:	2.88
IP(EA), eV:	-8.75(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-[4-[2-(2,5-dimethylpyrrolidin-1-yl)ethyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)(CNC(=O)NC2=NC3=C(S2)SC=C3)O

DOS

IR

Vibrations