Geometry & MOs

Info

ID:	247802
PubChem CID:	103073299
Reduced:	NSC10H21 (1)
Stoich.:	ABC10D21 (1)
Weight, g/mol:	187.139471
ΔH_f, kcal/mol:	-13.18
Dipole, Da:	3.24
IP(EA), eV:	-8.75(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[methyl(3-methylbutan-2-yl)amino]methyl]prop-2-ene-1-thiol

Drug info:

PubChemData

Smile

CCCC(C)N(C)CC(=C)CS

DOS

IR

Vibrations