Geometry & MOs

Info

ID:	406237
PubChem CID:	135076986
Reduced:	O3N5C20H23 (1)
Stoich.:	A3B5C20D23 (1)
Weight, g/mol:	413.263819
ΔH_f, kcal/mol:	-17.61
Dipole, Da:	9.04
IP(EA), eV:	-9.5(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-azido-1-(tert-butylamino)-5-methyl-1-oxohexan-2-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C(C(CC1=CC=CC=C1)N=[N+]=[N-])OC(=O)C2=CC=CC=N2

DOS

IR

Vibrations