Geometry & MOs

Info

ID:	351689
PubChem CID:	127280776
Reduced:	O3N5C19H33 (1)
Stoich.:	A3B5C19D33 (1)
Weight, g/mol:	322.236876
ΔH_f, kcal/mol:	-161.24
Dipole, Da:	6.67
IP(EA), eV:	-8.59(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(azetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-N-cyclohexylacetamide

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)CCN2CCN(CC2)CC(=O)NC3CCCCC3)C

DOS

IR

Vibrations