Geometry & MOs

Info

ID:	399825
PubChem CID:	135042961
Reduced:	O4C6H9 (2)
Stoich.:	A4B6C9 (2)
Weight, g/mol:	263.126991
ΔH_f, kcal/mol:	-376.47
Dipole, Da:	3.14
IP(EA), eV:	-10.65(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(2-acetamidophenyl)iminocarbamate

Drug info:

PubChemData

Smile

CC(=O)O[C@@H]1C[C@@H]([C@H]([C@@H]([C@@H]1O)O)OC(=O)C)OC(=O)C

DOS

IR

Vibrations