Geometry & MOs

Info

ID:	442779
PubChem CID:	135256189
Reduced:	O2N9C27H27 (1)
Stoich.:	A2B9C27D27 (1)
Weight, g/mol:	221.091275
ΔH_f, kcal/mol:	89.61
Dipole, Da:	10.34
IP(EA), eV:	-9.08(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[6-(azidomethyl)pyridin-2-yl]amino]acetate

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC(=N1)CN2C=C(N=N2)C3=NC(=NC(=C3)C4=CC=CC(=C4)C#N)N)N5CCC(CC5)C(=O)O

DOS

IR

Vibrations