Geometry & MOs

Info

ID:	211346
PubChem CID:	80933521
Reduced:	N4C15H26 (1)
Stoich.:	A4B15C26 (1)
Weight, g/mol:	255.11384
ΔH_f, kcal/mol:	-14.88
Dipole, Da:	2.86
IP(EA), eV:	-8.63(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-2-ethyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=N1)NC2CCCCC2C)NCC

DOS

IR

Vibrations