Geometry & MOs

Info

ID:	262890
PubChem CID:	103327334
Reduced:	SN5C15H25 (1)
Stoich.:	AB5C15D25 (1)
Weight, g/mol:	293.167417
ΔH_f, kcal/mol:	27.64
Dipole, Da:	4.91
IP(EA), eV:	-8.08(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,6-dimethyl-4-N-[2-[methyl(propan-2-yl)amino]ethyl]thieno[2,3-d]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCC1=CC2=C(N=C(N=C2S1)NC)NCCN(C)C(C)C

DOS

IR

Vibrations