Geometry & MOs

Info

ID:	344572
PubChem CID:	127268156
Reduced:	O2N3C19H33 (1)
Stoich.:	A2B3C19D33 (1)
Weight, g/mol:	387.215806
ΔH_f, kcal/mol:	-131.11
Dipole, Da:	2.59
IP(EA), eV:	-8.99(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-yl)-2-[4-(2-cyclohexylacetyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(=O)N2CCN(CC2)CC(=O)NC3CCCC3

DOS

IR

Vibrations