Geometry & MOs

Info

ID:	354609
PubChem CID:	127287226
Reduced:	ON5C20H29 (1)
Stoich.:	AB5C20D29 (1)
Weight, g/mol:	350.268176
ΔH_f, kcal/mol:	-1.29
Dipole, Da:	2.9
IP(EA), eV:	-8.61(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclohexanecarbonyl)-N-[2-[cyclopropyl(methyl)amino]propyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C(N2)C3CCCN3C(=O)NCC(C)N(C)C4CC4

DOS

IR

Vibrations