Geometry & MOs

Info

ID:	383643
PubChem CID:	134975485
Reduced:	NOSCl2C10H11 (1)
Stoich.:	ABCD2E10F11 (1)
Weight, g/mol:	255.045092
ΔH_f, kcal/mol:	-22.76
Dipole, Da:	2.98
IP(EA), eV:	-7.6(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-chloroindol-1-yl)-phenylmethanone

Drug info:

PubChemData

Smile

CC[N+]1=C(C2=C(S1)C=C(C=C2)OC)Cl.[Cl-]

DOS

IR

Vibrations