Geometry & MOs

Info

ID:	373808
PubChem CID:	131320246
Reduced:	ON3C8H11 (1)
Stoich.:	AB3C8D11 (1)
Weight, g/mol:	165.090212
ΔH_f, kcal/mol:	7.66
Dipole, Da:	2.17
IP(EA), eV:	-9.18(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-2-(3-methyl-1,2-oxazol-5-yl)butanenitrile

Drug info:

PubChemData

Smile

CC1=C(NN(C1=O)C)CCC#N

DOS

IR

Vibrations