Geometry & MOs

Info

ID:	345545
PubChem CID:	127269845
Reduced:	O3N5C13H23 (1)
Stoich.:	A3B5C13D23 (1)
Weight, g/mol:	380.278741
ΔH_f, kcal/mol:	-81.36
Dipole, Da:	3.58
IP(EA), eV:	-8.79(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-cyclohexylacetyl)-N-(2-morpholin-4-ylpropyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCNC(=O)NCC(C)N2CCOCC2

DOS

IR

Vibrations