Geometry & MOs

Info

ID:	354643
PubChem CID:	127287260
Reduced:	O2N5C18H31 (1)
Stoich.:	A2B5C18D31 (1)
Weight, g/mol:	392.315127
ΔH_f, kcal/mol:	-53.51
Dipole, Da:	3.21
IP(EA), eV:	-8.55(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-cyclohexylacetyl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C2CCCN(C2)C(=O)NCC3CCCN(C3)C(C)C

DOS

IR

Vibrations