Geometry & MOs

Info

ID:	150622
PubChem CID:	53790315
Reduced:	C8H17 (2)
Stoich.:	A8B17 (2)
Weight, g/mol:	250.139137
ΔH_f, kcal/mol:	-89.12
Dipole, Da:	0.08
IP(EA), eV:	-10.57(4.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-phenyl 2,2-dimethylheptanethioate

Drug info:

PubChemData

Smile

CC(C)CCCC(C)(C)CCCC(C)(C)C

DOS

IR

Vibrations