Geometry & MOs

Info

ID:	247273
PubChem CID:	103069324
Reduced:	SN2C12H24 (1)
Stoich.:	AB2C12D24 (1)
Weight, g/mol:	226.15037
ΔH_f, kcal/mol:	0.92
Dipole, Da:	3.52
IP(EA), eV:	-8.55(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N'-methyl-2-methylidene-N'-(thiolan-3-yl)propane-1,3-diamine

Drug info:

PubChemData

Smile

CCCNCC(=C)CN(C)C1CCSC1

DOS

IR

Vibrations