Geometry & MOs

Info

ID:	210606
PubChem CID:	80829495
Reduced:	N5C12H21 (1)
Stoich.:	A5B12C21 (1)
Weight, g/mol:	249.195346
ΔH_f, kcal/mol:	18.61
Dipole, Da:	3.38
IP(EA), eV:	-8.68(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N,6-N,2-trimethyl-4-N-[(1-methylpyrrolidin-3-yl)methyl]pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)N(C)CC2CCN(C2)C)N

DOS

IR

Vibrations