Geometry & MOs

Info

ID:	442718
PubChem CID:	135255929
Reduced:	ON2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	290.13789
ΔH_f, kcal/mol:	-19.5
Dipole, Da:	4.13
IP(EA), eV:	-9.84(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[6-(azidomethyl)pyridin-2-yl]-3-hydroxycyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)CCC(C)(C)C1=CC=CC(=N1)CN=[N+]=[N-]

DOS

IR

Vibrations