Geometry & MOs

Info

ID:	435023
PubChem CID:	135177803
Reduced:	NO3C10H20 (2)
Stoich.:	AB3C10D20 (2)
Weight, g/mol:	1276.524295
ΔH_f, kcal/mol:	-304.48
Dipole, Da:	6.36
IP(EA), eV:	-9.95(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[8-[[2,7-bis[2-hydroxy-3-(4-propoxybenzoyl)oxypropoxy]naphthalen-1-yl]methyl]-7-[2-hydroxy-3-(4-propoxybenzoyl)oxypropoxy]naphthalen-2-yl]oxy-2-hydroxypropyl] 4-propoxybenzoate

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

CCC(C)CCCCC(=O)NCCOCCOCCOCCOCCC(=O)N

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

CCC(C)CCCCC(=O)NCCOCCOCCOCCOCCC(=O)N

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):