Geometry & MOs

Info

ID:	29503
PubChem CID:	834507
Reduced:	ClNOC16H18 (1)
Stoich.:	ABCD16E18 (1)
Weight, g/mol:	276.02621
ΔH_f, kcal/mol:	-10.97
Dipole, Da:	3.93
IP(EA), eV:	-9.32(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)-N-(pyridin-2-ylmethyl)methanamine

Drug info:

PubChemData

Smile

C[C@H]([C@H](C1=CC=CC=C1)O)NCC2=CC=CC=C2Cl

DOS

IR

Vibrations