Geometry & MOs

Info

ID:	312842
PubChem CID:	126609124
Reduced:	N2C11H21 (1)
Stoich.:	A2B11C21 (1)
Weight, g/mol:	180.116173
ΔH_f, kcal/mol:	5.11
Dipole, Da:	3.1
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.787471
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-2-methoxy-1-(2-methoxyethoxy)butane

Drug info:

PubChemData

Smile

CC(C)(C)CC1=[N+](C=CC1)CCN

DOS

IR

Vibrations