Geometry & MOs

Info

ID:	15772
PubChem CID:	450260
Reduced:	N2S2C15H26 (1)
Stoich.:	A2B2C15D26 (1)
Weight, g/mol:	298.153741
ΔH_f, kcal/mol:	-14.43
Dipole, Da:	3.9
IP(EA), eV:	-8.34(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-[[2-[(2-methyl-2-sulfanylpropyl)amino]phenyl]methylamino]propane-2-thiol

Drug info:

PubChemData

Smile

CC(C)(CNCC1=CC=CC=C1NCC(C)(C)S)S

DOS

IR

Vibrations