Geometry & MOs

Info

ID:	360551
PubChem CID:	127301196
Reduced:	O3N5C17H31 (1)
Stoich.:	A3B5C17D31 (1)
Weight, g/mol:	393.310376
ΔH_f, kcal/mol:	-156.9
Dipole, Da:	4.96
IP(EA), eV:	-8.82(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclohexylcarbamoyl)-2-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CCNC(=O)N1CCN(CC1)CC(=O)NC(C)C(=O)N2CCCCC2

DOS

IR

Vibrations