Geometry & MOs

Info

ID:	292517
PubChem CID:	115354112
Reduced:	BrNOH12C17 (1)
Stoich.:	ABCD12E17 (1)
Weight, g/mol:	340.05751
ΔH_f, kcal/mol:	36.79
Dipole, Da:	1.98
IP(EA), eV:	-9.36(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-bromonaphthalen-2-yl)-N-methyl-2-pyridin-4-ylethanamine

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)CC(=O)C2=CC3=C(C=C2)C=C(C=C3)Br

DOS

IR

Vibrations