Geometry & MOs

Info

ID:	82997
PubChem CID:	49856968
Reduced:	NO4C21H27 (1)
Stoich.:	AB4C21D27 (1)
Weight, g/mol:	1587.39081
ΔH_f, kcal/mol:	-189.18
Dipole, Da:	3.01
IP(EA), eV:	-9.26(0.42)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=O)C[C@@H]1C[C@H]([C@H]2[C@@H]1CC(=O)N2C(=O)OC(C)(C)C)C3=CC=CC=C3

DOS

IR

Vibrations