Geometry & MOs

Info

ID:	327521
PubChem CID:	126690218
Reduced:	SC16H20 (1)
Stoich.:	AB16C20 (1)
Weight, g/mol:	270.093918
ΔH_f, kcal/mol:	18.03
Dipole, Da:	2.01
IP(EA), eV:	-8.71(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(E)-2-(4-aminophenyl)ethenyl]-1,4-dihydrothieno[3,2-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCC1=C(C\2=C(CCC/C2=C\C)C=C1)C(=C)S

DOS

IR

Vibrations