Geometry & MOs

Info

ID:	410157
PubChem CID:	135082948
Reduced:	OSC7H14 (1)
Stoich.:	ABC7D14 (1)
Weight, g/mol:	237.172879
ΔH_f, kcal/mol:	-36.41
Dipole, Da:	4.17
IP(EA), eV:	-8.74(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NZ)-N-[5-[(1S,2S,4R,6S)-7,7-dimethyl-3-oxatricyclo[4.1.1.02,4]octan-2-yl]pentan-2-ylidene]hydroxylamine

Drug info:

PubChemData

Smile

CCCC(=S=O)CCC

DOS

IR

Vibrations