Geometry & MOs

Info

ID:	271946
PubChem CID:	103704451
Reduced:	FN3C10H12 (1)
Stoich.:	AB3C10D12 (1)
Weight, g/mol:	304.081639
ΔH_f, kcal/mol:	21.57
Dipole, Da:	2.15
IP(EA), eV:	-9.17(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=C(C(=NC=N1)NCCCC#C)F

DOS

IR

Vibrations