Geometry & MOs

Info

ID:	251075
PubChem CID:	103101289
Reduced:	O2N3C13H21 (1)
Stoich.:	A2B3C13D21 (1)
Weight, g/mol:	313.07897
ΔH_f, kcal/mol:	-65.75
Dipole, Da:	2.82
IP(EA), eV:	-8.9(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-amino-1-(2-bromophenyl)propyl]-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(CN)C1=CC(=CC=C1)OC

DOS

IR

Vibrations