Geometry & MOs

Info

ID:	406644
PubChem CID:	135078245
Reduced:	NPO6C11H20 (2)
Stoich.:	ABC6D11E20 (2)
Weight, g/mol:	231.173548
ΔH_f, kcal/mol:	-680.58
Dipole, Da:	3.93
IP(EA), eV:	-8.03(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azido-1,4-ditert-butylbenzene

Drug info:

PubChemData

Smile

CCOP(=O)(OCC)OC1=CN(C(=CN1C(=O)OC(C)(C)C)OP(=O)(OCC)OCC)C(=O)OC(C)(C)C

DOS

IR

Vibrations