Geometry & MOs

Info

ID:

203257

PubChem CID:

79803102

Reduced:

SN3C12H17 (1)

Stoich.:

AB3C12D17 (1)

Weight, g/mol:

266.076536

ΔHf, kcal/mol:

47.44

Dipole, Da:

3.84

IP(EA), eV:

-8.44(0.05)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(4-methylthiophen-3-yl)-2-naphthalen-2-ylethanone

Drug info:

PubChemData

Smile

CCCC1=C(N(N=C1C2=CSC=C2C)C)N

DOS

IR

Vibrations