Geometry & MOs

Info

ID:	211944
PubChem CID:	81058904
Reduced:	N2O2C11H24 (1)
Stoich.:	A2B2C11D24 (1)
Weight, g/mol:	246.176585
ΔH_f, kcal/mol:	-110.83
Dipole, Da:	3.36
IP(EA), eV:	-9.12(1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(aminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)thian-3-amine

Drug info:

PubChemData

Smile

CCCC(CN)C(=O)N(C)CCOCC

DOS

IR

Vibrations