Geometry & MOs

Info

ID:	266364
PubChem CID:	103562971
Reduced:	SN2C11H18 (1)
Stoich.:	AB2C11D18 (1)
Weight, g/mol:	213.220498
ΔH_f, kcal/mol:	20.18
Dipole, Da:	2.27
IP(EA), eV:	-9.05(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(aminomethyl)-3-propan-2-ylcyclobutyl]-N',N'-dimethylethane-1,2-diamine

Drug info:

PubChemData

Smile

CC1CC(C1)(CN)NCC2=CC=CS2

DOS

IR

Vibrations