Geometry & MOs

Info

ID:	196289
PubChem CID:	78805194
Reduced:	ON2F3H15C16 (1)
Stoich.:	AB2C3D15E16 (1)
Weight, g/mol:	349.185335
ΔH_f, kcal/mol:	-147.76
Dipole, Da:	1.28
IP(EA), eV:	-10.26(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-difluorophenyl)-N-[(3-ethoxy-4-propoxyphenyl)methyl]ethanamine

Drug info:

PubChemData

Smile

C1CCC(C1)(C#N)NC(=O)/C=C/C2=CC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations