Geometry & MOs

Info

ID:	380623
PubChem CID:	134971118
Reduced:	NOC14H20 (2)
Stoich.:	ABC14D20 (2)
Weight, g/mol:	482.26983
ΔH_f, kcal/mol:	-25.48
Dipole, Da:	2.31
IP(EA), eV:	-8.33(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5S)-4-[(1S)-1-ethoxyprop-2-enyl]-5-(1-ethoxyprop-2-enyl)-1,3-bis[(1S)-1-phenylethyl]-1,3,2lambda5-diazaphospholidine 2-oxide

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

CCO[C@@H](C=C)[C@H]([C@@H](C(C=C)OCC)N[C@@H](C)C1=CC=CC=C1)N[C@@H](C)C2=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

CCO[C@@H](C=C)[C@H]([C@@H](C(C=C)OCC)N[C@@H](C)C1=CC=CC=C1)N[C@@H](C)C2=CC=CC=C2

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):