Geometry & MOs

Info

ID:	14056
PubChem CID:	403008
Reduced:	SN3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	283.114319
ΔH_f, kcal/mol:	58.12
Dipole, Da:	5.49
IP(EA), eV:	-8.44(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-dimethyl-N-(2-phenylethyl)thieno[2,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=C(SC2=NC=NC(=C12)NCCC3=CC=CC=C3)C

DOS

IR

Vibrations