Geometry & MOs

Info

ID:	289244
PubChem CID:	104341537
Reduced:	FON4C14H17 (1)
Stoich.:	ABC4D14E17 (1)
Weight, g/mol:	278.120132
ΔH_f, kcal/mol:	-44.34
Dipole, Da:	4.41
IP(EA), eV:	-8.77(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethyl)-6-N-methyl-4-N-(1-thiophen-3-ylethyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCOCC1=NC(=CC(=N1)NC2=CC(=C(C=C2)F)C)N

DOS

IR

Vibrations