Geometry & MOs

Info

ID:	288777
PubChem CID:	104325706
Reduced:	FON2C16H25 (1)
Stoich.:	ABC2D16E25 (1)
Weight, g/mol:	281.215493
ΔH_f, kcal/mol:	-90.0
Dipole, Da:	3.28
IP(EA), eV:	-7.92(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-dimethylheptan-4-yl)-4-ethoxy-3-fluoroaniline

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)NC(C)CC2CCCCN2)F

DOS

IR

Vibrations