Geometry & MOs

Info

ID:	21099
PubChem CID:	587188
Reduced:	ClON2H19C24 (1)
Stoich.:	ABC2D19E24 (1)
Weight, g/mol:	386.118591
ΔH_f, kcal/mol:	40.18
Dipole, Da:	3.66
IP(EA), eV:	-8.39(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chlorophenyl)-(1-phenyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)methanone

Drug info:

PubChemData

Smile

C1CN(C(C2=C1C3=CC=CC=C3N2)C4=CC=CC=C4)C(=O)C5=CC=CC=C5Cl

DOS

IR

Vibrations