Geometry & MOs

Info

ID:	217361
PubChem CID:	85087693
Reduced:	OS2N4C16H28 (1)
Stoich.:	AB2C4D16E28 (1)
Weight, g/mol:	356.220528
ΔH_f, kcal/mol:	-31.72
Dipole, Da:	7.08
IP(EA), eV:	-8.09(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-tert-butyl 2-[1-[tert-butyl(dimethyl)silyl]oxyprop-2-ynyl]hexanethioate

Drug info:

PubChemData

Smile

CCN1C(=C(C(=N1)C(=O)N2CCCC2C(SCC)SCC)N)C

DOS

IR

Vibrations