Geometry & MOs

Info

ID:	446698
PubChem CID:	135276994
Reduced:	OF2C7H14 (1)
Stoich.:	AB2C7D14 (1)
Weight, g/mol:	418.08562
ΔH_f, kcal/mol:	-182.13
Dipole, Da:	3.26
IP(EA), eV:	-10.76(2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-2-ethylphenyl)-2-(2,2-difluoroethyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole

Drug info:

PubChemData

Smile

CCC(C)CC(CO)(F)F

DOS

IR

Vibrations