Geometry & MOs

Info

ID:	372152
PubChem CID:	131293882
Reduced:	FN2C13H13 (1)
Stoich.:	AB2C13D13 (1)
Weight, g/mol:	205.065827
ΔH_f, kcal/mol:	10.11
Dipole, Da:	3.63
IP(EA), eV:	-9.64(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(6-chloronaphthalen-2-yl)ethanamine

Drug info:

PubChemData

Smile

C=CC[C@H](C1=NC2=C(C=CC(=C2)F)C=C1)N

DOS

IR

Vibrations