Geometry & MOs

Info

ID:	385788
PubChem CID:	134979981
Reduced:	NSO3C16H29 (1)
Stoich.:	ABC3D16E29 (1)
Weight, g/mol:	220.219101
ΔH_f, kcal/mol:	-171.75
Dipole, Da:	2.95
IP(EA), eV:	-9.26(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4E)-deca-1,4-dien-2-yl]cyclohexane

Drug info:

PubChemData

Smile

CCCSC(=O)C/C=C/C(C)CN(C)C(=O)OC(C)(C)C

DOS

IR

Vibrations