Geometry & MOs

Info

ID:	262866
PubChem CID:	103324360
Reduced:	SN4C15H22 (1)
Stoich.:	AB4C15D22 (1)
Weight, g/mol:	292.135782
ΔH_f, kcal/mol:	21.47
Dipole, Da:	4.46
IP(EA), eV:	-8.16(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-2-N-methyl-4-N-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCNC1=NC(=C2C=CSC2=N1)NC3CCCCC3C

DOS

IR

Vibrations