Geometry & MOs

Info

ID:	262824
PubChem CID:	103321033
Reduced:	SCl2N3H11C14 (1)
Stoich.:	AB2C3D11E14 (1)
Weight, g/mol:	313.101561
ΔH_f, kcal/mol:	64.15
Dipole, Da:	5.86
IP(EA), eV:	-8.97(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chloro-6-methylthieno[2,3-d]pyrimidin-4-yl)-pentan-3-ylamino]ethanol

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)Cl)NC2=C3C=CSC3=NC(=N2)Cl

DOS

IR

Vibrations