Geometry & MOs

Info

ID:	262891
PubChem CID:	103327336
Reduced:	SN5C14H23 (1)
Stoich.:	AB5C14D23 (1)
Weight, g/mol:	250.088832
ΔH_f, kcal/mol:	31.58
Dipole, Da:	4.46
IP(EA), eV:	-8.11(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]pyrrolidin-3-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations