Geometry & MOs

Info

ID:	206201
PubChem CID:	80218584
Reduced:	ClN2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	282.073532
ΔH_f, kcal/mol:	12.2
Dipole, Da:	1.51
IP(EA), eV:	-9.16(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chloropyridin-2-yl)-(3,4-difluorophenyl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCNC(CC1CCC1)C2=NC=C(C=C2)Cl

DOS

IR

Vibrations