Geometry & MOs

Info

ID:	263916
PubChem CID:	103407594
Reduced:	ClNOSC15H16 (1)
Stoich.:	ABCDE15F16 (1)
Weight, g/mol:	286.021914
ΔH_f, kcal/mol:	15.98
Dipole, Da:	2.61
IP(EA), eV:	-8.9(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-4-methylthiophen-2-yl)-naphthalen-2-ylmethanone

Drug info:

PubChemData

Smile

CC1=CSC(=C1Cl)C(C2=CC=C(C=C2)OC3CC3)N

DOS

IR

Vibrations