Geometry & MOs

Info

ID:	413281
PubChem CID:	135086228
Reduced:	ON2C17H34 (1)
Stoich.:	AB2C17D34 (1)
Weight, g/mol:	113.084064
ΔH_f, kcal/mol:	-87.33
Dipole, Da:	4.53
IP(EA), eV:	-8.88(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethylbut-3-yn-1-amine oxide

Drug info:

PubChemData

Smile

CCCNCCCCCCCCCC(C(C)(C)C#N)O

DOS

IR

Vibrations