Geometry & MOs

Info

ID:	199226
PubChem CID:	79220061
Reduced:	NOSC18H21 (1)
Stoich.:	ABCD18E21 (1)
Weight, g/mol:	221.189198
ΔH_f, kcal/mol:	2.87
Dipole, Da:	4.29
IP(EA), eV:	-8.61(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4,6-diethyl-2-methylpyrimidin-5-yl)-N-ethylethanamine

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)SCC2COC3=CC=CC=C23)NC

DOS

IR

Vibrations