Geometry & MOs

Info

ID:	365355
PubChem CID:	127317754
Reduced:	O3N4C22H24 (1)
Stoich.:	A3B4C22D24 (1)
Weight, g/mol:	334.180504
ΔH_f, kcal/mol:	-88.21
Dipole, Da:	10.92
IP(EA), eV:	-8.31(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetamido-4-fluorophenyl)-4-cyclobutylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC2=C1C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(=O)N4CCCC4

DOS

IR

Vibrations