Geometry & MOs

Info

ID:	318788
PubChem CID:	126653245
Reduced:	N2O2F3C9H17 (1)
Stoich.:	A2B2C3D9E17 (1)
Weight, g/mol:	390.236601
ΔH_f, kcal/mol:	-247.54
Dipole, Da:	1.58
IP(EA), eV:	-9.04(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetyl]piperazine-1-carboxylate

Drug info:

PubChemData

Smile

C1CN(CCN1)C[C@H](COCC(F)(F)F)O

DOS

IR

Vibrations