Geometry & MOs

Info

ID:	225137
PubChem CID:	85741930
Reduced:	O2S2C5H10 (1)
Stoich.:	A2B2C5D10 (1)
Weight, g/mol:	202.146999
ΔH_f, kcal/mol:	-89.42
Dipole, Da:	5.68
IP(EA), eV:	-9.06(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylhex-5-en-3-yl)-2-prop-1-enylpropanedinitrile

Drug info:

PubChemData

Smile

CC1SCCCS1(=O)=O

DOS

IR

Vibrations