Geometry & MOs

Info

ID:	363804
PubChem CID:	127313451
Reduced:	O2N5C17H27 (1)
Stoich.:	A2B5C17D27 (1)
Weight, g/mol:	387.232205
ΔH_f, kcal/mol:	-51.79
Dipole, Da:	4.9
IP(EA), eV:	-8.9(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-1-(3-fluorophenyl)cyclobutane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)C(=O)NCCN2CCN(CC2)C(=O)C3CCC3

DOS

IR

Vibrations