Geometry & MOs

Info

ID:	264964
PubChem CID:	103504789
Reduced:	NOF2H15C16 (1)
Stoich.:	ABC2D15E16 (1)
Weight, g/mol:	321.01645
ΔH_f, kcal/mol:	-101.85
Dipole, Da:	3.89
IP(EA), eV:	-8.88(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]phenol

Drug info:

PubChemData

Smile

CC(C1=C(C=C(C=C1)F)O)N2CCC3=C2C=C(C=C3)F

DOS

IR

Vibrations