Geometry & MOs

Info

ID:	289162
PubChem CID:	104338010
Reduced:	ON4C14H16 (1)
Stoich.:	AB4C14D16 (1)
Weight, g/mol:	277.124883
ΔH_f, kcal/mol:	20.0
Dipole, Da:	2.73
IP(EA), eV:	-9.35(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(ethoxymethyl)-N-ethyl-6-(3-methylthiophen-2-yl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

COCC1=NC(=CC(=N1)N)C2CCC3=C2N=CC=C3

DOS

IR

Vibrations