Geometry & MOs

Info

ID:	249509
PubChem CID:	103090121
Reduced:	OSC12H24 (1)
Stoich.:	ABC12D24 (1)
Weight, g/mol:	172.10342
ΔH_f, kcal/mol:	-92.54
Dipole, Da:	0.49
IP(EA), eV:	-8.48(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dimethylamino)-5-methylsulfanylpentanenitrile

Drug info:

PubChemData

Smile

CC1CCCC(C1)C(CCCSC)O

DOS

IR

Vibrations