Geometry & MOs

Info

ID:	310676
PubChem CID:	126584239
Reduced:	FOSN2H15C17 (1)
Stoich.:	ABCD2E15F17 (1)
Weight, g/mol:	312.01095
ΔH_f, kcal/mol:	-7.39
Dipole, Da:	2.88
IP(EA), eV:	-8.37(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(7-bromo-1-methyl-4-nitroindol-3-yl)propan-1-ol

Drug info:

PubChemData

Smile

C1C(CN1SC2=CC=C(C=C2)C3=CNC4=C3C=CC(=C4)F)O

DOS

IR

Vibrations