Geometry & MOs

Info

ID:	294673
PubChem CID:	117480459
Reduced:	BrNOC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	297.07283
ΔH_f, kcal/mol:	-27.26
Dipole, Da:	0.63
IP(EA), eV:	-9.32(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-bromo-5-(cyclobutylmethoxy)phenyl]propan-1-amine

Drug info:

PubChemData

Smile

CC(=C)COC1=CC=CC(=C1Br)CC(C)(C)N

DOS

IR

Vibrations