Geometry & MOs

Info

ID:	210642
PubChem CID:	80833029
Reduced:	N5H13C14 (1)
Stoich.:	A5B13C14 (1)
Weight, g/mol:	221.164046
ΔH_f, kcal/mol:	86.29
Dipole, Da:	1.99
IP(EA), eV:	-8.73(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-methyl-4-N-(2-pyrrolidin-1-ylethyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CC1=CN=C(N=C1NC2=CC3=C(C=C2)N=CC=C3)N

DOS

IR

Vibrations