Geometry & MOs

Info

ID:	367951
PubChem CID:	127326134
Reduced:	N2F3C13H23 (1)
Stoich.:	A2B3C13D23 (1)
Weight, g/mol:	364.283826
ΔH_f, kcal/mol:	-186.14
Dipole, Da:	3.55
IP(EA), eV:	-8.53(1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-(4-methylcyclohexyl)piperazin-1-yl]propanoyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)N2CCN(CC2)CC(F)(F)F

DOS

IR

Vibrations