Geometry & MOs

Info

ID:	294438
PubChem CID:	117461119
Reduced:	BrNO2C12H16 (1)
Stoich.:	ABC2D12E16 (1)
Weight, g/mol:	285.03644
ΔH_f, kcal/mol:	-69.59
Dipole, Da:	2.0
IP(EA), eV:	-8.6(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-aminocyclobutyl)-5-bromo-2-methoxy-4-methylphenol

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1CC(C)N)Br)OCCO2

DOS

IR

Vibrations