Geometry & MOs

Info

ID:	262924
PubChem CID:	103329735
Reduced:	OSN5C12H17 (1)
Stoich.:	ABC5D12E17 (1)
Weight, g/mol:	305.131031
ΔH_f, kcal/mol:	-7.32
Dipole, Da:	2.03
IP(EA), eV:	-8.69(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-[[2-(ethylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propanamide

Drug info:

PubChemData

Smile

CC(C)CNC(=O)CNC1=C2C=CSC2=NC(=N1)N

DOS

IR

Vibrations