Geometry & MOs

Info

ID:	296485
PubChem CID:	117578110
Reduced:	N5C11H17 (1)
Stoich.:	A5B11C17 (1)
Weight, g/mol:	221.164046
ΔH_f, kcal/mol:	61.38
Dipole, Da:	3.67
IP(EA), eV:	-8.94(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N,2-dimethyl-4-N-(pyrrolidin-3-ylmethyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)NC2CNC2)NC3CC3

DOS

IR

Vibrations