Geometry & MOs

Info

ID:	213310
PubChem CID:	81063415
Reduced:	ClNS2O3C10H16 (1)
Stoich.:	ABC2D3E10F16 (1)
Weight, g/mol:	186.173213
ΔH_f, kcal/mol:	-111.36
Dipole, Da:	4.6
IP(EA), eV:	-9.64(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-methyl-1-N-(2-propan-2-yloxyethyl)cyclobutane-1,3-diamine

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=CSC(=C1)CCl

DOS

IR

Vibrations