Geometry & MOs

Info

ID:	205073
PubChem CID:	80051730
Reduced:	ClON2C15H19 (1)
Stoich.:	ABC2D15E19 (1)
Weight, g/mol:	273.03567
ΔH_f, kcal/mol:	-19.47
Dipole, Da:	5.62
IP(EA), eV:	-8.45(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloro-1H-indol-3-yl)-(4-fluorophenyl)methanone

Drug info:

PubChemData

Smile

C1CC(OC1)CNCCN2C=CC3=C2C=CC=C3Cl

DOS

IR

Vibrations