Geometry & MOs

Info

ID:	344394
PubChem CID:	127267570
Reduced:	N2O2C13H18 (1)
Stoich.:	A2B2C13D18 (1)
Weight, g/mol:	377.21147
ΔH_f, kcal/mol:	-65.0
Dipole, Da:	4.46
IP(EA), eV:	-9.75(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-fluoro-5-morpholin-4-ylanilino)-3-oxopropyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CN(CC#N)C(=O)C1CC2CCCC(C1)C2=O

DOS

IR

Vibrations