Geometry & MOs

Info

ID:	284328
PubChem CID:	104043509
Reduced:	O2N3C14H25 (1)
Stoich.:	A2B3C14D25 (1)
Weight, g/mol:	296.153621
ΔH_f, kcal/mol:	-78.5
Dipole, Da:	1.46
IP(EA), eV:	-8.68(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-4-fluorophenyl)-2-(2,6-dimethyloxan-4-yl)oxyacetamide

Drug info:

PubChemData

Smile

CCCC1=NN(C(=C1N)OC2CC(OC(C2)C)C)C

DOS

IR

Vibrations