Geometry & MOs

Info

ID:	304027
PubChem CID:	124491442
Reduced:	ON2C4H6 (2)
Stoich.:	AB2C4D6 (2)
Weight, g/mol:	124.100048
ΔH_f, kcal/mol:	-36.49
Dipole, Da:	7.13
IP(EA), eV:	-9.85(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-cyclobutylpropanenitrile

Drug info:

PubChemData

Smile

CC1=C(N=NN1[C@@H]2CCNC2)C(=O)O

DOS

IR

Vibrations