Geometry & MOs

Info

ID:	165032
PubChem CID:	74487615
Reduced:	FN2O3H21C24 (1)
Stoich.:	AB2C3D21E24 (1)
Weight, g/mol:	389.255266
ΔH_f, kcal/mol:	-101.3
Dipole, Da:	4.65
IP(EA), eV:	-9.16(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

8-(4-hydroxybutan-2-yl)-1-(2-methylpropyl)-3-(pyridin-2-ylmethyl)-1,3-diaza-8-azoniaspiro[4.5]decane-2,4-dione

Drug info:

PubChemData

Smile

COC(=O)CNC(=O)C1=C2CCCC(=CC3=CC=C(C=C3)F)C2=NC4=CC=CC=C41

DOS

IR

Vibrations