Geometry & MOs

Info

ID:	424842
PubChem CID:	135124158
Reduced:	N2O3C13H14 (1)
Stoich.:	A2B3C13D14 (1)
Weight, g/mol:	380.144868
ΔH_f, kcal/mol:	-44.5
Dipole, Da:	3.91
IP(EA), eV:	-9.52(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC2=C1NC(=O)C23CCCC3)[N+](=O)[O-]

DOS

IR

Vibrations