Geometry & MOs

Info

ID:	432047
PubChem CID:	135172179
Reduced:	ON4C17H36 (1)
Stoich.:	AB4C17D36 (1)
Weight, g/mol:	184.128572
ΔH_f, kcal/mol:	-79.86
Dipole, Da:	2.73
IP(EA), eV:	-8.44(2.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylidene-6-pentylthiane

Drug info:

PubChemData

Smile

CC(C)(CCC(C)(C)N1CCC(C(C1)O)N)N2CCNCC2

DOS

IR

Vibrations