Geometry & MOs

Info

ID:	144650
PubChem CID:	53393050
Reduced:	ON4H22C25 (1)
Stoich.:	AB4C22D25 (1)
Weight, g/mol:	336.133006
ΔH_f, kcal/mol:	92.26
Dipole, Da:	7.73
IP(EA), eV:	-9.05(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5-bis(dimethylamino)-1,5-dithiophen-2-ylpentan-3-one

Drug info:

PubChemData

Smile

CCC(C)OC1=CC=C(C=C1)C2=CC3=NN=C(N3C=C2)C4=CC=NC5=CC=CC=C45

DOS

IR

Vibrations