Geometry & MOs

Info

ID:	333535
PubChem CID:	127252087
Reduced:	N6C19H20 (1)
Stoich.:	A6B19C20 (1)
Weight, g/mol:	255.148396
ΔH_f, kcal/mol:	116.96
Dipole, Da:	2.14
IP(EA), eV:	-8.98(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-methylpyrrolidin-3-yl)-N-pyridin-2-ylpyrimidin-2-amine

Drug info:

PubChemData

Smile

C1CN(CC1C2=NC(=NC=C2)NC3=NC=CC=N3)CC4=CC=CC=C4

DOS

IR

Vibrations