Geometry & MOs

Info

ID:	395461
PubChem CID:	135025531
Reduced:	NO6C19H31 (1)
Stoich.:	AB6C19D31 (1)
Weight, g/mol:	291.158292
ΔH_f, kcal/mol:	-280.04
Dipole, Da:	3.9
IP(EA), eV:	-9.61(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-(2-methylpropanoylamino)phenyl]iminocarbamate

Drug info:

PubChemData

Smile

CC[C@H]([C@H]1CCC[C@@H]2N1C(=O)CCC3C2CC(=O)O3)OCOCCOC

DOS

IR

Vibrations