Geometry & MOs

Info

ID:	337014
PubChem CID:	127256579
Reduced:	NO2C8H13 (1)
Stoich.:	AB2C8D13 (1)
Weight, g/mol:	155.094629
ΔH_f, kcal/mol:	-36.05
Dipole, Da:	2.6
IP(EA), eV:	-10.96(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methylbutyl 2H-azirine-3-carboxylate

Drug info:

PubChemData

Smile

CCCC(C)OC(=O)C1C=N1

DOS

IR

Vibrations