Geometry & MOs

Info

ID:	18723
PubChem CID:	547002
Reduced:	FON2C20H21 (1)
Stoich.:	ABC2D20E21 (1)
Weight, g/mol:	324.163791
ΔH_f, kcal/mol:	-46.35
Dipole, Da:	4.15
IP(EA), eV:	-8.46(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)-(4-fluorophenyl)methanone

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C3C2CN(CC3)C)C(=O)C4=CC=C(C=C4)F

DOS

IR

Vibrations