Geometry & MOs

Info

ID:	262832
PubChem CID:	103321580
Reduced:	SCl2N3H13C15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	297.070261
ΔH_f, kcal/mol:	69.14
Dipole, Da:	6.33
IP(EA), eV:	-8.76(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)Cl)N(C)C2=C3C=CSC3=NC(=N2)Cl

DOS

IR

Vibrations