Geometry & MOs

Info

ID:	296401
PubChem CID:	117571836
Reduced:	ClNC6H8 (2)
Stoich.:	ABC6D8 (2)
Weight, g/mol:	184.193949
ΔH_f, kcal/mol:	7.89
Dipole, Da:	2.57
IP(EA), eV:	-8.61(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(methylaminomethyl)cyclobutyl]methyl]butan-1-amine

Drug info:

PubChemData

Smile

C1CC(C1)(CN)CNC2=C(C(=CC=C2)Cl)Cl

DOS

IR

Vibrations