Geometry & MOs

Info

ID:	294432
PubChem CID:	117460654
Reduced:	BrNO3C11H12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	285.03644
ΔH_f, kcal/mol:	-82.09
Dipole, Da:	2.24
IP(EA), eV:	-9.19(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-2-ethoxy-4-methoxyphenyl)cyclopropan-1-amine

Drug info:

PubChemData

Smile

CCC1=C(C2=C(C=C1C(=O)CN)OCO2)Br

DOS

IR

Vibrations