Geometry & MOs

Info

ID:	336465
PubChem CID:	127255472
Reduced:	ClNOH3C4 (2)
Stoich.:	ABCD3E4 (2)
Weight, g/mol:	300.108562
ΔH_f, kcal/mol:	-53.98
Dipole, Da:	7.23
IP(EA), eV:	-9.61(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-(aminomethyl)naphthalen-2-yl]methanamine;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

C1=C(C(=C(N=C1Cl)/C=C/C(=O)O)Cl)N

DOS

IR

Vibrations