Geometry & MOs

Info

ID:	322521
PubChem CID:	126670364
Reduced:	O3C23H34 (1)
Stoich.:	A3B23C34 (1)
Weight, g/mol:	194.089599
ΔH_f, kcal/mol:	-154.86
Dipole, Da:	6.37
IP(EA), eV:	-9.67(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-chloroethylsulfanyl)-2,2-dimethylpentane

Drug info:

PubChemData

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C[C@]12CCC3C(C1CCC2C4(OCCO4)C)CCC5=CC(=O)CC[C@]35C

DOS

IR

Vibrations