Geometry & MOs

Info

ID:	428554
PubChem CID:	135167668
Reduced:	NOC8H17 (2)
Stoich.:	ABC8D17 (2)
Weight, g/mol:	254.010508
ΔH_f, kcal/mol:	-131.36
Dipole, Da:	1.02
IP(EA), eV:	-8.15(1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-methylsulfanyl-2-propan-2-yloxycarbothioylsulfanylacetate

Drug info:

PubChemData

Smile

CC(C)(C)N1CCN(CC1)CCOCCOC(C)(C)C

DOS

IR

Vibrations