Geometry & MOs

Info

ID:	445976
PubChem CID:	135270768
Reduced:	FO2N5H24C27 (1)
Stoich.:	AB2C5D24E27 (1)
Weight, g/mol:	377.10204
ΔH_f, kcal/mol:	32.88
Dipole, Da:	10.86
IP(EA), eV:	-9.54(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-N-ethenyl-1-[3-[4-(1H-imidazol-5-yl)phenyl]thieno[3,2-b]thiophen-6-yl]but-1-en-1-amine

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)F)C2=CC=CC=C2/C(=C(\C=O)/C#N)/NC3CN(C3)C(=O)C4=CC=NC=C4

DOS

IR

Vibrations