Geometry & MOs

Info

ID:	422685
PubChem CID:	135118245
Reduced:	O2N4C17H28 (1)
Stoich.:	A2B4C17D28 (1)
Weight, g/mol:	262.215747
ΔH_f, kcal/mol:	-67.83
Dipole, Da:	2.67
IP(EA), eV:	-9.08(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-propyl-N-(2-pyrrolidin-1-ylpropyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC(C)N1C(=CC=N1)C(=O)N2CC[C@]3(CCCN([C@@H]3C2)C)CO

DOS

IR

Vibrations