Geometry & MOs

Info

ID:	210258
PubChem CID:	80781853
Reduced:	SN4C14H20 (1)
Stoich.:	AB4C14D20 (1)
Weight, g/mol:	276.140868
ΔH_f, kcal/mol:	40.51
Dipole, Da:	3.08
IP(EA), eV:	-8.59(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-ethyl-4-N,2,5-trimethyl-4-N-(thiophen-3-ylmethyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCCNC1=C(C(=NC=N1)NC(C)C2=CC=CS2)C

DOS

IR

Vibrations