Geometry & MOs

Info

ID:	68156
PubChem CID:	46507853
Reduced:	ClSO2N3C26H28 (1)
Stoich.:	ABC2D3E26F28 (1)
Weight, g/mol:	256.078268
ΔH_f, kcal/mol:	-16.19
Dipole, Da:	4.47
IP(EA), eV:	-8.22(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[7-(4-methylphenyl)thieno[3,2-d]pyrimidin-4-yl]hydrazine

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)SC2=NN=C(C=C2)N3CCC(CC3)C(=O)OCC4=CC(=CC=C4)Cl

DOS

IR

Vibrations