Geometry & MOs

Info

ID:	197156
PubChem CID:	78929684
Reduced:	ON5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	220.078268
ΔH_f, kcal/mol:	28.0
Dipole, Da:	4.83
IP(EA), eV:	-8.14(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CCN(CC2)C3=NC=NC(=C3)N

DOS

IR

Vibrations