Geometry & MOs

Info

ID:	378852
PubChem CID:	134224953
Reduced:	NO6C19H21 (1)
Stoich.:	AB6C19D21 (1)
Weight, g/mol:	748.666639
ΔH_f, kcal/mol:	-191.28
Dipole, Da:	1.45
IP(EA), eV:	-8.4(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-2-[N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-methylcarbamimidoyl]-1-[7-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)nonyl]guanidine

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

COC1=C[C@]23CCCN2CCC4=CC5=C(C=C4[C@@H]3[C@@H]1OC(=O)O)OCO5

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

COC1=C[C@]23CCCN2CCC4=CC5=C(C=C4[C@@H]3[C@@H]1OC(=O)O)OCO5

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):