Geometry & MOs

Info

ID:	262888
PubChem CID:	103327147
Reduced:	SN4C15H22 (1)
Stoich.:	AB4C15D22 (1)
Weight, g/mol:	306.151433
ΔH_f, kcal/mol:	22.33
Dipole, Da:	4.17
IP(EA), eV:	-8.2(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(2-amino-6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexyl]methanol

Drug info:

PubChemData

Smile

CCCC1CCN(CC1)C2=C3C=C(SC3=NC(=N2)N)C

DOS

IR

Vibrations