Geometry & MOs

Info

ID:	267750
PubChem CID:	103588088
Reduced:	BrNO3C16H16 (1)
Stoich.:	ABC3D16E16 (1)
Weight, g/mol:	312.04734
ΔH_f, kcal/mol:	-87.28
Dipole, Da:	3.45
IP(EA), eV:	-8.79(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-amino-5-bromophenoxy)-N-cyclopentylacetamide

Drug info:

PubChemData

Smile

COC(=O)CC1=CC=CC=C1COC2=CC(=CC(=C2)N)Br

DOS

IR

Vibrations