Geometry & MOs

Info

ID:	215927
PubChem CID:	85085452
Reduced:	OC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	196.157563
ΔH_f, kcal/mol:	-119.06
Dipole, Da:	3.63
IP(EA), eV:	-9.78(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(dimethylamino)ethenyl]-3-hydroxy-5-methylhexanenitrile

Drug info:

PubChemData

Smile

C1CCC2(CCCC2CO)CC(=O)C1

DOS

IR

Vibrations