Geometry & MOs

Info

ID:	274513
PubChem CID:	103809845
Reduced:	FON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	281.246713
ΔH_f, kcal/mol:	-96.32
Dipole, Da:	3.17
IP(EA), eV:	-8.93(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[(3-methylcyclohexyl)methyl]-2-piperazin-1-ylpropanamide

Drug info:

PubChemData

Smile

CC1CCCC(C1)CNC(=O)C2=CC(=C(C=C2)F)N

DOS

IR

Vibrations