Geometry & MOs

Info

ID:	19317
PubChem CID:	561162
Reduced:	NO8C23H33 (1)
Stoich.:	AB8C23D33 (1)
Weight, g/mol:	451.220617
ΔH_f, kcal/mol:	-376.66
Dipole, Da:	4.26
IP(EA), eV:	-9.63(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O,1-O-ditert-butyl 3-O-methyl 3-(phenylmethoxycarbonylamino)propane-1,1,3-tricarboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C(CC(C(=O)OC)NC(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C

DOS

IR

Vibrations