Geometry & MOs

Info

ID:	351264
PubChem CID:	127280152
Reduced:	O3N4C20H30 (1)
Stoich.:	A3B4C20D30 (1)
Weight, g/mol:	387.215806
ΔH_f, kcal/mol:	-133.23
Dipole, Da:	5.16
IP(EA), eV:	-8.71(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1,3-benzodioxole-4-carbonyl)piperazin-1-yl]-N-cyclohexyl-N-methylacetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C(=O)N1)C(=O)N2CCN(CC2)CC(=O)N(C)C3CCCCC3

DOS

IR

Vibrations