Geometry & MOs

Info

ID:	245953
PubChem CID:	103031122
Reduced:	BrNO2C12H20 (1)
Stoich.:	ABC2D12E20 (1)
Weight, g/mol:	227.224915
ΔH_f, kcal/mol:	-68.58
Dipole, Da:	3.55
IP(EA), eV:	-9.08(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-4-methyl-1-(2-methylcyclopropyl)-N-propylpentan-1-amine

Drug info:

PubChemData

Smile

CC(C)(CCC(C1=CC=C(O1)Br)NC)OC

DOS

IR

Vibrations