Geometry & MOs

Info

ID:	446154
PubChem CID:	135272752
Reduced:	NC3H3 (8)
Stoich.:	AB3C3 (8)
Weight, g/mol:	248.127326
ΔH_f, kcal/mol:	160.09
Dipole, Da:	6.91
IP(EA), eV:	-9.32(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[6-(azidomethyl)pyridin-2-yl]butanoate

Drug info:

PubChemData

Smile

CC(C)C(C)C1=CC=CC(=N1)CN2C=C(N=N2)C3=NC(=NC(=C3)C4=CC=CC(=C4)C#N)N

DOS

IR

Vibrations