Geometry & MOs

Info

ID:	375131
PubChem CID:	131472596
Reduced:	FON2C12H15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	201.101445
ΔH_f, kcal/mol:	-59.39
Dipole, Da:	1.04
IP(EA), eV:	-9.43(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-aminoethyl)-6-methylimidazo[1,5-a]pyrimidine-8-carbonitrile

Drug info:

PubChemData

Smile

CCCC(C1=NC2=C(O1)C=C(C(=C2)C)F)N

DOS

IR

Vibrations