Geometry & MOs

Info

ID:	263282
PubChem CID:	103352169
Reduced:	N2O2C17H24 (1)
Stoich.:	A2B2C17D24 (1)
Weight, g/mol:	282.15437
ΔH_f, kcal/mol:	-71.14
Dipole, Da:	2.41
IP(EA), eV:	-8.86(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(aminomethyl)-4-ethylpiperidin-1-yl]-(2,5-difluorophenyl)methanone

Drug info:

PubChemData

Smile

CCC1CCN(C(C1)CN)C(=O)C2CC3=CC=CC=C3O2

DOS

IR

Vibrations