Geometry & MOs

Info

ID:	382247
PubChem CID:	134973274
Reduced:	N3O4C33H51 (1)
Stoich.:	A3B4C33D51 (1)
Weight, g/mol:	623.393436
ΔH_f, kcal/mol:	-195.39
Dipole, Da:	6.25
IP(EA), eV:	-8.7(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4S,5S)-4-(dibenzylamino)-5-(2,2,4,4-tetramethyl-1,3-oxazolidine-3-carbonyl)oxyhexyl] 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate

Drug info:

PubChemData

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔH_f, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(S_z, S²):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

CC(C)N(C(C)C)C(=O)OCCC[C@@H](COC(=O)N(C(C)C)C(C)C)N(CC1=CC=CC=C1)CC2=CC=CC=C2

DOS

IR

Vibrations

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔHf, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(Sz, S2):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

CC(C)N(C(C)C)C(=O)OCCC[C@@H](COC(=O)N(C(C)C)C(C)C)N(CC1=CC=CC=C1)CC2=CC=CC=C2

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):