Geometry & MOs

Info

ID:	296493
PubChem CID:	117578517
Reduced:	N5H13C14 (1)
Stoich.:	A5B13C14 (1)
Weight, g/mol:	263.210996
ΔH_f, kcal/mol:	94.68
Dipole, Da:	2.37
IP(EA), eV:	-8.57(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-[3-(methylaminomethyl)pyrrolidin-1-yl]-N-propan-2-ylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)N2CCC3=CC=CC=C32)NC#N

DOS

IR

Vibrations