Geometry & MOs

Info

ID:	199331
PubChem CID:	79231297
Reduced:	BrNOC18H20 (1)
Stoich.:	ABCD18E20 (1)
Weight, g/mol:	345.07283
ΔH_f, kcal/mol:	-3.41
Dipole, Da:	2.0
IP(EA), eV:	-8.65(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-bromophenyl)methyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

Drug info:

PubChemData

Smile

COC1=CC2=C(CCCC2NCC3=CC(=CC=C3)Br)C=C1

DOS

IR

Vibrations