Geometry & MOs

Info

ID:	221652
PubChem CID:	85285829
Reduced:	NSnO2C30H49 (1)
Stoich.:	ABC2D30E49 (1)
Weight, g/mol:	574.193429
ΔH_f, kcal/mol:	-87.59
Dipole, Da:	2.83
IP(EA), eV:	-9.07(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-amino-4-[[5-[[amino(nitramido)methylidene]amino]-2-azaniumylpentanoyl]-methylamino]-5-oxopentyl]azanium;2,2,2-trifluoroacetate

Drug info:

PubChemData

Smile

CCCC[Sn](CCCC)(CCCC)C=CCN1C2CCC1C(C(C2)C3=CC=CC=C3)C(=O)OC

DOS

IR

Vibrations