Geometry & MOs

Info

ID:	424518
PubChem CID:	135122984
Reduced:	N2O5C17H20 (1)
Stoich.:	A2B5C17D20 (1)
Weight, g/mol:	441.165269
ΔH_f, kcal/mol:	-142.07
Dipole, Da:	6.26
IP(EA), eV:	-9.84(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-benzyl-5-[2-(2,4-difluorophenyl)pyrazol-3-yl]spiro[1H-indole-3,1'-cyclobutane]-2-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])C3(C1=O)CCCC3

DOS

IR

Vibrations