Geometry & MOs

Info

ID:	202283
PubChem CID:	79651612
Reduced:	ON3C15H29 (1)
Stoich.:	AB3C15D29 (1)
Weight, g/mol:	281.210327
ΔH_f, kcal/mol:	-77.12
Dipole, Da:	4.82
IP(EA), eV:	-8.88(1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-cyclopropylpiperazin-1-yl)-1-(ethylamino)cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CNC1(CCC(C1)N(C)CC2CCCCC2)C(=O)N

DOS

IR

Vibrations