Geometry & MOs

Info

ID:	440666
PubChem CID:	135230869
Reduced:	F2O3C13H14 (1)
Stoich.:	A2B3C13D14 (1)
Weight, g/mol:	471.193375
ΔH_f, kcal/mol:	-186.83
Dipole, Da:	4.99
IP(EA), eV:	-10.05(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-difluoro-N-(2-fluorocyclopropylidene)-4-[(1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]benzamide

Drug info:

PubChemData

Smile

CCOC(=O)C1CC1C2=CC(=C(C(C2)F)C=O)F

DOS

IR

Vibrations