Geometry & MOs

Info

ID:	291896
PubChem CID:	113635234
Reduced:	N2O2C13H24 (1)
Stoich.:	A2B2C13D24 (1)
Weight, g/mol:	251.14339
ΔH_f, kcal/mol:	-96.71
Dipole, Da:	2.9
IP(EA), eV:	-8.72(1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-fluorophenyl)-2-[(3S)-3-methylpiperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

C[C@H]1CN(CCN1)C2CCOC3(C2)CCOC3

DOS

IR

Vibrations