Geometry & MOs

Info

ID:	289285
PubChem CID:	104343954
Reduced:	O2N3C16H21 (1)
Stoich.:	A2B3C16D21 (1)
Weight, g/mol:	273.147727
ΔH_f, kcal/mol:	-39.07
Dipole, Da:	1.36
IP(EA), eV:	-9.04(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-(methoxymethyl)-6-(4-methylphenoxy)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC1=CC(=NC(=N1)COCC)OC2=CC=C(C=C2)C

DOS

IR

Vibrations