Geometry & MOs

Info

ID:	368087
PubChem CID:	127327457
Reduced:	ON5C20H31 (1)
Stoich.:	AB5C20D31 (1)
Weight, g/mol:	276.195011
ΔH_f, kcal/mol:	-18.88
Dipole, Da:	3.68
IP(EA), eV:	-8.76(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-6-methyl-N-[2-(3-methylmorpholin-4-yl)ethyl]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)C2CC2)N3CCN(CC3)C(C)C(=O)NC4CCCC4

DOS

IR

Vibrations