Geometry & MOs

Info

ID:	262917
PubChem CID:	103329495
Reduced:	OSN4C14H22 (1)
Stoich.:	ABC4D14E22 (1)
Weight, g/mol:	292.147016
ΔH_f, kcal/mol:	-7.68
Dipole, Da:	2.67
IP(EA), eV:	-8.18(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,6-dimethyl-4-N-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CC1=CC2=C(N=C(N=C2S1)NC)N(CCOC)C(C)C

DOS

IR

Vibrations