Geometry & MOs

Info

ID:	225539
PubChem CID:	85852809
Reduced:	FH5C6 (5)
Stoich.:	AB5C6 (5)
Weight, g/mol:	274.125218
ΔH_f, kcal/mol:	-176.02
Dipole, Da:	4.11
IP(EA), eV:	-9.38(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-(1-phenylethyl)-1,2,4a,7a-tetrahydrothieno[2,3-d]pyrimidin-4-yl]hydrazine

Drug info:

PubChemData

Smile

CCCC1=C(C=C(C=C1)C2=C(C=C(C=C2F)C3=CC=C(C=C3)C4=C(C(=C(C=C4)CCC)F)F)F)F

DOS

IR

Vibrations