Geometry & MOs

Info

ID:	370784
PubChem CID:	127340566
Reduced:	ON3C16H29 (1)
Stoich.:	AB3C16D29 (1)
Weight, g/mol:	371.177982
ΔH_f, kcal/mol:	-60.0
Dipole, Da:	3.43
IP(EA), eV:	-8.81(1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-cyclopentyl-1,4-diazepan-1-yl)-2-(2-pyrazin-2-yl-1,3-thiazol-4-yl)ethanone

Drug info:

PubChemData

Smile

CN1CCC(C1)C(=O)N2CCCN(CC2)C3CCCC3

DOS

IR

Vibrations