Geometry & MOs

Info

ID:	424619
PubChem CID:	135123352
Reduced:	N2O4C7H14 (1)
Stoich.:	A2B4C7D14 (1)
Weight, g/mol:	562.177168
ΔH_f, kcal/mol:	-198.59
Dipole, Da:	8.61
IP(EA), eV:	-10.02(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7'-(2-chloropyridin-4-yl)oxy-1'-[(4-methoxyphenyl)methyl]-5'-(2-phenylpyrazol-3-yl)spiro[cyclobutane-1,3'-indole]-2'-one

Drug info:

PubChemData

Smile

CCC(CNC(=O)O)CNC(=O)O

DOS

IR

Vibrations