Geometry & MOs

Info

ID:	199857
PubChem CID:	79308049
Reduced:	N3C7H11 (1)
Stoich.:	A3B7C11 (1)
Weight, g/mol:	235.132077
ΔH_f, kcal/mol:	66.39
Dipole, Da:	3.43
IP(EA), eV:	-9.72(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-cyano-3-(prop-2-ynylamino)azetidine-1-carboxylate

Drug info:

PubChemData

Smile

C=CCNC1(CNC1)C#N

DOS

IR

Vibrations