Geometry & MOs

Info

ID:	205579
PubChem CID:	80123006
Reduced:	ON7C10H13 (1)
Stoich.:	AB7C10D13 (1)
Weight, g/mol:	370.95241
ΔH_f, kcal/mol:	100.66
Dipole, Da:	6.19
IP(EA), eV:	-9.73(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-bromo-2,6-difluorophenyl)-chloromethyl]-1,3-dihydroindol-2-one

Drug info:

PubChemData

Smile

C1CC1NC(=O)CCNC2=NN3C(=NN=N3)C=C2

DOS

IR

Vibrations